Orb2564466 (CAS 2070864-23-0): price, suppliers and safety

What is Orb2564466?

Plain description, key identifiers and synonyms

Orb2564466 is a chemical substance with the molecular formula C27H27N5O3 and a molar mass of 469.55 g/mol. Its CAS registry number is 2070864-23-0. The IUPAC name is 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]-6-(2-pyrrolidin-3-ylethynyl)imidazo[4,5-b]pyridine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name: 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]-6-(2-pyrrolidin-3-ylethynyl)imidazo[4,5-b]pyridine
CAS number: 2070864-23-0
Molecular formula: C₂₇H₂₇N₅O₃
InChIKey: KXNBFQQSVWHOOC-UHFFFAOYSA-N
InChI: InChI=1S/C27H27N5O3/c1-33-25-12-21(5-7-24(25)35-17-22-6-8-26(34-2)29-15-22)16-32-18-31-23-11-20(14-30-27(23)32)4-3-19-9-10-28-13-19/h5-8,11-12,14-15,18-19,28H,9-10,13,16-17H2,1-2H3
SMILES (canonical and isomeric): COC1=NC=C(C=C1)COC2=C(C=C(C=C2)CN3C=NC4=C3N=CC(=C4)C#CC5CCNC5)OC

Synonyms

US11274108, Example 1-253
3-(3-methoxy-4-((6-methoxypyridin-3-yl)methoxy)benzyl)- 6-(pyrrolidin-3-ylethynyl)-3H-imidazo[4,5-b]pyridine
3-(3-methoxy-4-((6-methoxypyridin-3-yl)methoxy)benzyl)-6-(pyrrolidin-3-ylethynyl)-3H-imidazo[4,5-b]pyridine

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	469.55 g/molcalc.
Exact mass	469.2114 Dacalc.
LogP (octanol/water)	3.43calc.
Topological polar surface area	83.32 Å²calc.
Hydrogen bond donors	1calc.
Hydrogen bond acceptors	7calc.
Rotatable bonds	7calc.
Heavy atoms	35calc.
Rings	5calc.
Aromatic rings	4calc.
Fraction sp3 carbons	0.3calc.
Formal charge	0calc.
Stereocentres	1calc.
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

C(#CC1CCNC1)c1cnc2c(c1)ncn2Cc1ccc(OCc2cccnc2)cc1

5 rings, 31 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.

Orb2564466 suppliers

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Orb2564466 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 Orb2564466 is traded under.

HS 2933.39Indicative HS code

Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure…

World exports in 2024

$9.16B

−17.9% vs 2023, imports $10.6B

2019 to 2024

Top exporters

China21.5%
India * partner reported12.3%
Ireland11.6%

Top importers

* Partner reported figures, a lower bound.

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

The HS code shown for Orb2564466 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

Cp-724714 chemical structure, C27H27N5O3, CAS 383432-38-0

Cp-724714383432-38-0C₂₇H₂₇N₅O₃1 supplier

Seralutinib chemical structure, C27H27N5O3, CAS 1619931-27-9

Seralutinib1619931-27-9C₂₇H₂₇N₅O₃1 supplier

(E)-2-Cyano-N-(4-morpholin-4-ylphenyl)-3-(2-morpholin-4-ylquinolin-3-yl)prop-2-enamide chemical structure, C27H27N5O3, CAS 851290-86-3

(E)-2-Cyano-N-(4-morpholin-4-ylphenyl)-3-(2-morpholin-4-ylquinolin-3-yl)prop-2-enamide851290-86-3C₂₇H₂₇N₅O₃

4-((4-(4-(2-(Diethylamino)-2-oxoethoxy)phenyl)phthalazin-1-yl)amino)benzamide chemical structure, C27H27N5O3, CAS 685132-01-8

4-((4-(4-(2-(Diethylamino)-2-oxoethoxy)phenyl)phthalazin-1-yl)amino)benzamide685132-01-8C₂₇H₂₇N₅O₃

5-(4-(Cyclopropanecarbonyl)piperazin-1-yl)-1-methyl-3-(naphthalen-1-ylmethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione chemical structure, C27H27N5O3, CAS 1021095-24-8

5-(4-(Cyclopropanecarbonyl)piperazin-1-yl)-1-methyl-3-(naphthalen-1-ylmethyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione1021095-24-8C₂₇H₂₇N₅O₃

(E)-Ethyl (3-(4-((3-methyl-4-((6-methylpyridin-3-yl)oxy)phenyl)amino)quinazolin-6-yl)allyl)carbamate chemical structure, C27H27N5O3, CAS 537705-08-1

(E)-Ethyl (3-(4-((3-methyl-4-((6-methylpyridin-3-yl)oxy)phenyl)amino)quinazolin-6-yl)allyl)carbamate537705-08-1C₂₇H₂₇N₅O₃

2-(Dimethylamino)-5-methyl-1-(4-nitrophenyl)-4-(2-oxocyclohexyl)-4H-pyrido[3,2-b]indole-3-carbonitrile chemical structure, C27H27N5O3, CAS 184772-00-7

2-(Dimethylamino)-5-methyl-1-(4-nitrophenyl)-4-(2-oxocyclohexyl)-4H-pyrido[3,2-b]indole-3-carbonitrile184772-00-7C₂₇H₂₇N₅O₃

4-(3,4-Dimethylphenyl)-2-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]phthalazin-1-one chemical structure, C27H27N5O3, CAS 317324-53-1

4-(3,4-Dimethylphenyl)-2-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]phthalazin-1-one317324-53-1C₂₇H₂₇N₅O₃

(E)-N-(3-Cyano-10-methyl-5-oxo-1-pentyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-4-ethoxybenzamide chemical structure, C27H27N5O3, CAS 847380-33-0

(E)-N-(3-Cyano-10-methyl-5-oxo-1-pentyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-4-ethoxybenzamide847380-33-0C₂₇H₂₇N₅O₃

(E)-N-(3-Cyano-1-(3-ethoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3,4-dimethylbenzamide chemical structure, C27H27N5O3, CAS 848064-51-7

(E)-N-(3-Cyano-1-(3-ethoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3,4-dimethylbenzamide848064-51-7C₂₇H₂₇N₅O₃

(E)-4-(tert-Butyl)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)benzamide chemical structure, C27H27N5O3, CAS 845661-64-5

(E)-4-(tert-Butyl)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)benzamide845661-64-5C₂₇H₂₇N₅O₃

3-[3-(4-Ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-5,7-dimethyl-6-(2-methylbenzyl)pyrazolo[1,5-a]pyrimidine chemical structure, C27H27N5O3, CAS 1030090-34-6

3-[3-(4-Ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-5,7-dimethyl-6-(2-methylbenzyl)pyrazolo[1,5-a]pyrimidine1030090-34-6C₂₇H₂₇N₅O₃

Frequently asked questions

Quick answers about Orb2564466, based on the data on this page

What is Orb2564466?

Orb2564466 is a chemical substance with the molecular formula C27H27N5O3 and a molar mass of 469.55 g/mol. Its CAS registry number is 2070864-23-0. The IUPAC name is 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]-6-(2-pyrrolidin-3-ylethynyl)imidazo[4,5-b]pyridine.

What is the CAS number of Orb2564466?

The CAS registry number of Orb2564466 is 2070864-23-0.

What is the molecular formula and weight of Orb2564466?

The molecular formula of Orb2564466 is C27H27N5O3 and its molar mass is 469.55 g/mol.

What is Orb2564466 used for?

Known uses and roles of Orb2564466 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb2564466 hazardous?

No GHS hazard classification for Orb2564466 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 Orb2564466?

Orb2564466 is usually classified under HS code 293339 (Compounds containing an unfused pyridine ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb2564466?

Post a free request on CompoundList and suppliers of Orb2564466 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb2564466?

Suppliers quote Orb2564466 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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Orb2564466

Key facts

What is Orb2564466?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

Orb2564466 suppliers

Orb2564466 price

Uses and applications

Industries and functions

Regulatory status

HS code and trade data

Global trade

Frequently asked questions

What is Orb2564466?

What is the CAS number of Orb2564466?

What is the molecular formula and weight of Orb2564466?

What is Orb2564466 used for?

Is Orb2564466 hazardous?

What is the HS code of Orb2564466?

Where can I buy Orb2564466?

What is the price of Orb2564466?

Guides for buyers

Get quotes for Orb2564466

Key facts

What is Orb2564466?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

Orb2564466 suppliers

Orb2564466 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 Orb2564466?

What is the CAS number of Orb2564466?

What is the molecular formula and weight of Orb2564466?

What is Orb2564466 used for?

Is Orb2564466 hazardous?

What is the HS code of Orb2564466?

Where can I buy Orb2564466?

What is the price of Orb2564466?

Guides for buyers

Get quotes for Orb2564466