CaspPro (CAS 1060253-24-8): price, suppliers and safety

What is CaspPro?

Plain description, key identifiers and synonyms

CaspPro is a chemical substance with the molecular formula C20H22N6O2S and a molar mass of 410.50 g/mol. Its CAS registry number is 1060253-24-8. The IUPAC name is 3-cyclopropyl-6-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name: 3-cyclopropyl-6-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CAS number: 1060253-24-8
Molecular formula: C₂₀H₂₂N₆O₂S
InChIKey: JDOAIOBLXZJZBL-XNTDXEJSSA-N
InChI: InChI=1S/C20H22N6O2S/c27-29(28,15-10-16-4-2-1-3-5-16)25-13-11-24(12-14-25)19-9-8-18-21-22-20(17-6-7-17)26(18)23-19/h1-5,8-10,15,17H,6-7,11-14H2/b15-10+
Canonical SMILES: O=S(=O)(C=Cc1ccccc1)N1CCN(c2ccc3nnc(C4CC4)n3n2)CC1
Isomeric SMILES: C1CC1C2=NN=C3N2N=C(C=C3)N4CCN(CC4)S(=O)(=O)/C=C/C5=CC=CC=C5

Synonyms

3-cyclopropyl-6-[4-(2-phenyl-ethenesulfonyl)-piperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
(E)-3-cyclopropyl-6-(4-(styrylsulfonyl)piperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine
3-cyclopropyl-6-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
3-cyclopropyl-5-{4-[(E)-2-phenylethenylsulfonyl]-1-piperazinyl}-1,2,3a,4-tetraazaindene

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight	410.50 g/molcalc.
Exact mass	410.1525 Dacalc.
LogP (octanol/water)	2.12calc.
Topological polar surface area	83.7 Å²calc.
Hydrogen bond donors	0calc.
Hydrogen bond acceptors	6calc.
Rotatable bonds	5calc.
Heavy atoms	29calc.
Rings	5calc.
Aromatic rings	3calc.
Fraction sp3 carbons	0.35calc.
Formal charge	0calc.
Stereocentres	0calc.
Lipinski rule of five	Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

O=S(=O)(C=Cc1ccccc1)N1CCN(c2ccc3nnc(C4CC4)n3n2)CC1

5 rings, 29 atoms.

No other chemical in our database has this scaffold.

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

CaspPro suppliers

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CaspPro price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Industries and functions

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code CaspPro is traded under.

HS 2935.90Indicative HS code

Sulphonamides, other

World exports in 2024

$5.64B

−11.0% vs 2023, imports $8.56B

2019 to 2024

Top exporters

Ireland43.1%
China12.0%
India * partner reported9.5%

Top importers

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for CaspPro is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Parent and salt forms, stereoisomers, similar structures and isomers

Similar structures

Nearest neighbours by Morgan fingerprint Tanimoto similarity

(E)-3-Methyl-6-(4-(styrylsulfonyl)piperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine chemical structure, C18H20N6O2S, CAS 1060306-48-0

(E)-3-(Furan-2-yl)-6-(4-(styrylsulfonyl)piperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine chemical structure, C21H20N6O3S, CAS 1060345-23-4

3-Cyclopropyl-6-(4-(phenethylsulfonyl)piperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine chemical structure, C20H24N6O2S, CAS 1040642-00-9

1-(2-Chlorobenzenesulfonyl)-4-{3-cyclopropyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}piperazine chemical structure, C18H19ClN6O2S, CAS 1040641-79-9

1-{3-Cyclopropyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}-4-(2-fluorobenzenesulfonyl)piperazine chemical structure, C18H19FN6O2S, CAS 1040640-97-8

Same formula isomers

Different compounds that share this molecular formula

All isomers

Methanesulfonamide, N-[2-[2-(2,6-dicyano-4-methylphenyl)diazenyl]-5-(diethylamino)phenyl]- chemical structure, C20H22N6O2S, CAS 68385-96-6

Methanesulfonamide, N-[2-[2-(2,6-dicyano-4-methylphenyl)diazenyl]-5-(diethylamino)phenyl]-68385-96-6C₂₀H₂₂N₆O₂S

N-[2-[6-(2-Oxo-2-pyrrolidin-1-ylethyl)sulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]benzamide chemical structure, C20H22N6O2S, CAS 894011-05-3

N-[2-[6-(2-Oxo-2-pyrrolidin-1-ylethyl)sulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl]benzamide894011-05-3C₂₀H₂₂N₆O₂S

2-((6-(1H-Pyrazol-1-yl)pyrimidin-4-yl)thio)-1-(4-(4-methoxyphenyl)piperazin-1-yl)ethanone chemical structure, C20H22N6O2S, CAS 1251604-48-4

2-((6-(1H-Pyrazol-1-yl)pyrimidin-4-yl)thio)-1-(4-(4-methoxyphenyl)piperazin-1-yl)ethanone1251604-48-4C₂₀H₂₂N₆O₂S

2-((4,6-Dimethylpyrimidin-2-yl)amino)-N-(4-morpholinophenyl)thiazole-4-carboxamide chemical structure, C20H22N6O2S, CAS 1251563-89-9

2-((4,6-Dimethylpyrimidin-2-yl)amino)-N-(4-morpholinophenyl)thiazole-4-carboxamide1251563-89-9C₂₀H₂₂N₆O₂S

1-[6-(2-Methoxyphenyl)pyridazin-3-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide chemical structure, C20H22N6O2S, CAS 1226437-35-9

1-[6-(2-Methoxyphenyl)pyridazin-3-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide1226437-35-9C₂₀H₂₂N₆O₂S

(5-(((4,6-Dimethylpyrimidin-2-yl)thio)methyl)-1-phenyl-1H-1,2,3-triazol-4-yl)(morpholino)methanone chemical structure, C20H22N6O2S, CAS 1172728-93-6

(5-(((4,6-Dimethylpyrimidin-2-yl)thio)methyl)-1-phenyl-1H-1,2,3-triazol-4-yl)(morpholino)methanone1172728-93-6C₂₀H₂₂N₆O₂S

(2-((2-Methoxy-5-methylphenyl)amino)thiazol-4-yl)(4-(pyrimidin-2-yl)piperazin-1-yl)methanone chemical structure, C20H22N6O2S, CAS 1170370-53-2

(2-((2-Methoxy-5-methylphenyl)amino)thiazol-4-yl)(4-(pyrimidin-2-yl)piperazin-1-yl)methanone1170370-53-2C₂₀H₂₂N₆O₂S

3-(4-Butyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-(pyridin-4-ylmethyl)propanamide chemical structure, C20H22N6O2S, CAS 1215543-68-2

3-(4-Butyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-(pyridin-4-ylmethyl)propanamide1215543-68-2C₂₀H₂₂N₆O₂S

3-(1-(tert-Butyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)-N-(6-methylbenzo[d]thiazol-2-yl)propanamide chemical structure, C20H22N6O2S, CAS 953241-31-1

3-(1-(tert-Butyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)-N-(6-methylbenzo[d]thiazol-2-yl)propanamide953241-31-1C₂₀H₂₂N₆O₂S

6-(4-(Benzylsulfonyl)piperazin-1-yl)-N-(pyridin-4-yl)pyridazin-3-amine chemical structure, C20H22N6O2S, CAS 1021039-31-5

6-(4-(Benzylsulfonyl)piperazin-1-yl)-N-(pyridin-4-yl)pyridazin-3-amine1021039-31-5C₂₀H₂₂N₆O₂S

$N-[4-(Diethylamino)-2-methylphenyl]-2-{5-oxo-12-thia-3,4,6,8-tetraazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2,7,10-tetraen-4-yl}acetamide chemical structure, C20H22N6O2S, CAS 1019180-22-3$

N-[4-(Diethylamino)-2-methylphenyl]-2-{5-oxo-12-thia-3,4,6,8-tetraazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2,7,10-tetraen-4-yl}acetamide1019180-22-3C₂₀H₂₂N₆O₂S

Atr-IN-8 chemical structure, C20H22N6O2S, CAS 2672511-20-3

Atr-IN-82672511-20-3C₂₀H₂₂N₆O₂S

Frequently asked questions

Quick answers about CaspPro, based on the data on this page

What is CaspPro?

CaspPro is a chemical substance with the molecular formula C20H22N6O2S and a molar mass of 410.50 g/mol. Its CAS registry number is 1060253-24-8. The IUPAC name is 3-cyclopropyl-6-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine.

What is the CAS number of CaspPro?

The CAS registry number of CaspPro is 1060253-24-8.

What is the molecular formula and weight of CaspPro?

The molecular formula of CaspPro is C20H22N6O2S and its molar mass is 410.50 g/mol.

What is CaspPro used for?

Known uses and roles of CaspPro include building blocks in research and laboratory and screening compounds in research and laboratory.

Is CaspPro hazardous?

No GHS hazard classification for CaspPro is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of CaspPro?

CaspPro is usually classified under HS code 293590 (Sulphonamides, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy CaspPro?

Post a free request on CompoundList and suppliers of CaspPro will send you quotes. Your contact details stay private until you accept a quote.

What is the price of CaspPro?

Suppliers quote CaspPro on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle CaspPro

CaspPro

Key facts

What is CaspPro?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

CaspPro suppliers

CaspPro price

Uses and applications

Industries and functions

Regulatory status

HS code and trade data

Global trade

Frequently asked questions

What is CaspPro?

What is the CAS number of CaspPro?

What is the molecular formula and weight of CaspPro?

What is CaspPro used for?

Is CaspPro hazardous?

What is the HS code of CaspPro?

Where can I buy CaspPro?

What is the price of CaspPro?

Guides for buyers

Get quotes for CaspPro

Key facts

What is CaspPro?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

CaspPro suppliers

CaspPro price

Uses and applications

Industries and functions

Regulatory status

HS code and trade data

Global trade

Related chemicals

Similar structures

Same formula isomers

Frequently asked questions

What is CaspPro?

What is the CAS number of CaspPro?

What is the molecular formula and weight of CaspPro?

What is CaspPro used for?

Is CaspPro hazardous?

What is the HS code of CaspPro?

Where can I buy CaspPro?

What is the price of CaspPro?

Guides for buyers

Get quotes for CaspPro