Orb2565118 (CAS 2945983-00-4): price, suppliers and safety

What is Orb2565118?

Plain description, key identifiers and synonyms

Orb2565118 is a chemical substance with the molecular formula C18H23N3O4S and a molar mass of 377.47 g/mol. Its CAS registry number is 2945983-00-4. The IUPAC name is 5-[(2-methoxy-4-prop-2-enylphenoxy)methyl]-3-(morpholin-4-ylmethyl)-1,3,4-oxadiazole-2-thione.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name: 5-[(2-methoxy-4-prop-2-enylphenoxy)methyl]-3-(morpholin-4-ylmethyl)-1,3,4-oxadiazole-2-thione
CAS number: 2945983-00-4
Molecular formula: C₁₈H₂₃N₃O₄S
InChIKey: MJGWQHOWGVEFRN-UHFFFAOYSA-N
InChI: InChI=1S/C18H23N3O4S/c1-3-4-14-5-6-15(16(11-14)22-2)24-12-17-19-21(18(26)25-17)13-20-7-9-23-10-8-20/h3,5-6,11H,1,4,7-10,12-13H2,2H3
SMILES (canonical and isomeric): COC1=C(C=CC(=C1)CC=C)OCC2=NN(C(=S)O2)CN3CCOCC3

Synonyms

5-[(2-Methoxy-4-prop-2-enylphenoxy)methyl]-3-(morpholin-4-ylmethyl)-1,3,4-oxadiazole-2-thione

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	377.47 g/molcalc.
Exact mass	377.1409 Dacalc.
LogP (octanol/water)	2.81calc.
Topological polar surface area	61.89 Å²calc.
Hydrogen bond donors	0calc.
Hydrogen bond acceptors	7calc.
Rotatable bonds	8calc.
Heavy atoms	26calc.
Rings	3calc.
Aromatic rings	2calc.
Fraction sp3 carbons	0.44calc.
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

S=c1oc(COc2ccccc2)nn1CN1CCOCC1

3 rings, 21 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.

Orb2565118 suppliers

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Orb2565118 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 Orb2565118 is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024

$26.7B

+15.0% vs 2023, imports $26.3B

2019 to 2024

Top exporters

Ireland26.3%
China15.7%
Singapore10.3%

Top importers

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

The HS code shown for Orb2565118 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

Same formula isomers

Different compounds that share this molecular formula

All isomers

Phentolamine methanesulfonate chemical structure, C18H23N3O4S, CAS 65-28-1

Phentolamine methanesulfonate65-28-1C₁₈H₂₃N₃O₄S112 suppliers

N-Cyclohexyl-2-{[5-(2,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide chemical structure, C18H23N3O4S, CAS 851129-68-5

N-Cyclohexyl-2-{[5-(2,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide851129-68-5C₁₈H₂₃N₃O₄S

(2E)-N-[5-(2-Methylpropyl)-1,3,4-thiadiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide chemical structure, C18H23N3O4S, CAS 1164543-72-9

(2E)-N-[5-(2-Methylpropyl)-1,3,4-thiadiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide1164543-72-9C₁₈H₂₃N₃O₄S

N-(N-(3,4-Dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide chemical structure, C18H23N3O4S, CAS 869075-50-3

N-(N-(3,4-Dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide869075-50-3C₁₈H₂₃N₃O₄S

(E)-N-(5-tert-Butyl-1,3,4-thiadiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide chemical structure, C18H23N3O4S, CAS 1164533-86-1

(E)-N-(5-tert-Butyl-1,3,4-thiadiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide1164533-86-1C₁₈H₂₃N₃O₄S

5-(4-Benzylpiperidin-1-yl)sulfonyl-1,3-dimethylpyrimidine-2,4-dione chemical structure, C18H23N3O4S, CAS 874806-78-7

5-(4-Benzylpiperidin-1-yl)sulfonyl-1,3-dimethylpyrimidine-2,4-dione874806-78-7C₁₈H₂₃N₃O₄S

N-Cyclohexyl-2-((5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl)thio)acetamide chemical structure, C18H23N3O4S, CAS 486398-00-9

N-Cyclohexyl-2-((5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl)thio)acetamide486398-00-9C₁₈H₂₃N₃O₄S

Methyl 4-methoxy-3-(3-thiomorpholin-4-ylpropanoylamino)-1H-indole-2-carboxylate chemical structure, C18H23N3O4S, CAS 845649-97-0

Methyl 4-methoxy-3-(3-thiomorpholin-4-ylpropanoylamino)-1H-indole-2-carboxylate845649-97-0C₁₈H₂₃N₃O₄S

N-{[(Cyclobutylmethyl)(tetrahydro-2-furanylmethyl)amino]carbonothioyl}-3-nitrobenzamide chemical structure, C18H23N3O4S, CAS 671794-17-5

N-{[(Cyclobutylmethyl)(tetrahydro-2-furanylmethyl)amino]carbonothioyl}-3-nitrobenzamide671794-17-5C₁₈H₂₃N₃O₄S

N-(2-(tert-Butyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-(4-methoxyphenyl)acetamide chemical structure, C18H23N3O4S, CAS 449784-65-0

N-(2-(tert-Butyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-(4-methoxyphenyl)acetamide449784-65-0C₁₈H₂₃N₃O₄S

3-Ethyl-5-methyl-N-(4-piperidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide chemical structure, C18H23N3O4S, CAS 898135-32-5

3-Ethyl-5-methyl-N-(4-piperidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide898135-32-5C₁₈H₂₃N₃O₄S

N-(2-tert-Butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-(3-methylphenoxy)acetamide chemical structure, C18H23N3O4S, CAS 893924-26-0

N-(2-tert-Butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-(3-methylphenoxy)acetamide893924-26-0C₁₈H₂₃N₃O₄S

Frequently asked questions

Quick answers about Orb2565118, based on the data on this page

What is Orb2565118?

Orb2565118 is a chemical substance with the molecular formula C18H23N3O4S and a molar mass of 377.47 g/mol. Its CAS registry number is 2945983-00-4. The IUPAC name is 5-[(2-methoxy-4-prop-2-enylphenoxy)methyl]-3-(morpholin-4-ylmethyl)-1,3,4-oxadiazole-2-thione.

What is the CAS number of Orb2565118?

The CAS registry number of Orb2565118 is 2945983-00-4.

What is the molecular formula and weight of Orb2565118?

The molecular formula of Orb2565118 is C18H23N3O4S and its molar mass is 377.47 g/mol.

What is Orb2565118 used for?

Known uses and roles of Orb2565118 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb2565118 hazardous?

No GHS hazard classification for Orb2565118 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 Orb2565118?

Orb2565118 is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb2565118?

Post a free request on CompoundList and suppliers of Orb2565118 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb2565118?

Suppliers quote Orb2565118 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

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Orb2565118

Key facts

What is Orb2565118?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

Orb2565118 suppliers

Orb2565118 price

Uses and applications

Industries and functions

Regulatory status

HS code and trade data

Global trade

Frequently asked questions

What is Orb2565118?

What is the CAS number of Orb2565118?

What is the molecular formula and weight of Orb2565118?

What is Orb2565118 used for?

Is Orb2565118 hazardous?

What is the HS code of Orb2565118?

Where can I buy Orb2565118?

What is the price of Orb2565118?

Guides for buyers

Get quotes for Orb2565118

Key facts

What is Orb2565118?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

Orb2565118 suppliers

Orb2565118 price

Uses and applications

Industries and functions

Regulatory status

HS code and trade data

Global trade

Related chemicals

Same formula isomers

Frequently asked questions

What is Orb2565118?

What is the CAS number of Orb2565118?

What is the molecular formula and weight of Orb2565118?

What is Orb2565118 used for?

Is Orb2565118 hazardous?

What is the HS code of Orb2565118?

Where can I buy Orb2565118?

What is the price of Orb2565118?

Guides for buyers

Get quotes for Orb2565118