Risimtinib (CAS 2126751-11-7): price, suppliers and safety

What is Risimtinib?

Plain description, key identifiers and synonyms

Risimtinib is a chemical substance with the molecular formula C30H31N5O3 and a molar mass of 509.61 g/mol. Its CAS registry number is 2126751-11-7. The IUPAC name is 6-[[2-[[4-[(3S,5R)-3,5-dimethylpiperazin-1-yl]benzoyl]amino]-4-pyridinyl]oxy]-N-methylnaphthalene-1-carboxamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name: 6-[[2-[[4-[(3S,5R)-3,5-dimethylpiperazin-1-yl]benzoyl]amino]-4-pyridinyl]oxy]-N-methylnaphthalene-1-carboxamide
CAS number: 2126751-11-7
Molecular formula: C₃₀H₃₁N₅O₃
UNII: EAF86A3767
InChIKey: CHZKEAYTNKCUEF-BGYRXZFFSA-N
InChI: InChI=1S/C30H31N5O3/c1-19-17-35(18-20(2)33-19)23-9-7-21(8-10-23)29(36)34-28-16-25(13-14-32-28)38-24-11-12-26-22(15-24)5-4-6-27(26)30(37)31-3/h4-16,19-20,33H,17-18H2,1-3H3,(H,31,37)(H,32,34,36)/t19-,20+
SMILES: C[C@@H]1CN(C[C@@H](N1)C)C2=CC=C(C=C2)C(=O)NC3=NC=CC(=C3)OC4=CC5=C(C=C4)C(=CC=C5)C(=O)NC

Synonyms

6-[[2-[[4-[(3S,5R)-3,5-dimethylpiperazin-1-yl]benzoyl]amino]-4-pyridinyl]oxy]-N-methylnaphthalene-1-carboxamide
compound S10
(13R,15S)-N,13,15 -trimethyl-3-oxo-6-oxa-4-aza-1(1)-piperazina-5(2,4)-pyridina-7(2)-naphthalena-2(1,4)-benzenaheptaphane-75-carboxamide
1-Naphthalenecarboxamide, 6-[[2-[[4-[(3R,5S)-3,5-dimethyl-1-piperazinyl]benzoyl]amino]-4-pyridinyl]oxy]-N-methyl-, rel-
rel-6-[[2-[[4-[(3R,5S)-3,5-Dimethyl-1-piperazinyl]benzoyl]amino]-4-pyridinyl]oxy]-N-methyl-1-naphthalenecarboxamide

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	509.61 g/molcalc.
Exact mass	509.2427 Dacalc.
LogP (octanol/water)	4.83calc.
Topological polar surface area	95.59 Å²calc.
Hydrogen bond donors	3calc.
Hydrogen bond acceptors	6calc.
Rotatable bonds	6calc.
Heavy atoms	38calc.
Rings	5calc.
Aromatic rings	4calc.
Fraction sp3 carbons	0.23calc.
Formal charge	0calc.
Stereocentres	2calc.
Lipinski rule of five	Passes (1 violation)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

O=C(Nc1cc(Oc2ccc3ccccc3c2)ccn1)c1ccc(N2CCNCC2)cc1

5 rings, 32 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.

Risimtinib suppliers

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Risimtinib 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 Risimtinib is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024

$18.4B

+10.5% vs 2023, imports $24.8B

2019 to 2024

Top exporters

Ireland43.6%
Switzerland * partner reported26.3%
China7.9%

Top importers

* Partner reported figures, a lower bound.

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

The HS code shown for Risimtinib 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

N-[2-(4-Ethoxyphenyl)ethyl]-3-[5-oxo-4-(2-phenylethyl)-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide chemical structure, C30H31N5O3, CAS 902970-28-9

N-[2-(4-Ethoxyphenyl)ethyl]-3-[5-oxo-4-(2-phenylethyl)-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide902970-28-9C₃₀H₃₁N₅O₃

2-[(2-Hydroxyethyl)amino]-1-[5-(4-methoxyphenyl)-3'-(4-methylphenyl)-1'-phenyl-3,4-dihydro-1'H,2H-[3,4'-bipyrazole]-2-yl]ethan-1-one chemical structure, C30H31N5O3, CAS 1020051-92-6

2-[(2-Hydroxyethyl)amino]-1-[5-(4-methoxyphenyl)-3'-(4-methylphenyl)-1'-phenyl-3,4-dihydro-1'H,2H-[3,4'-bipyrazole]-2-yl]ethan-1-one1020051-92-6C₃₀H₃₁N₅O₃

N-(4-Ethoxyphenethyl)-3-(4-(4-methylbenzyl)-5-oxo-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)propanamide chemical structure, C30H31N5O3, CAS 887224-39-7

N-(4-Ethoxyphenethyl)-3-(4-(4-methylbenzyl)-5-oxo-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)propanamide887224-39-7C₃₀H₃₁N₅O₃

LpxC-IN-10 chemical structure, C30H31N5O3, CAS 2413574-64-6

LpxC-IN-102413574-64-6C₃₀H₃₁N₅O₃

2-[(2-Methylphenyl)methyl]-4-[(4-methylphenyl)methyl]-N-(2-methylpropyl)-1,5-dioxo-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide chemical structure, C30H31N5O3, CAS 1223834-89-6

2-[(2-Methylphenyl)methyl]-4-[(4-methylphenyl)methyl]-N-(2-methylpropyl)-1,5-dioxo-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide1223834-89-6C₃₀H₃₁N₅O₃

4-Benzyl-2-(2,5-dimethylbenzyl)-N-isobutyl-1,5-dioxo-1,2,4,5-tetrahydro-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide chemical structure, C30H31N5O3, CAS 1242925-69-4

4-Benzyl-2-(2,5-dimethylbenzyl)-N-isobutyl-1,5-dioxo-1,2,4,5-tetrahydro-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide1242925-69-4C₃₀H₃₁N₅O₃

N-Isobutyl-2-(3-methylbenzyl)-4-(4-methylbenzyl)-1,5-dioxo-1,2,4,5-tetrahydro-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide chemical structure, C30H31N5O3, CAS 1223924-34-2

N-Isobutyl-2-(3-methylbenzyl)-4-(4-methylbenzyl)-1,5-dioxo-1,2,4,5-tetrahydro-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide1223924-34-2C₃₀H₃₁N₅O₃

N-Cyclohexyl-1,4,5,6-tetrahydro-5-[(3-methoxyphenyl)methyl]-4-oxo-1-phenylpyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-6-carboxamide chemical structure, C30H31N5O3, CAS 847021-87-8

N-Cyclohexyl-1,4,5,6-tetrahydro-5-[(3-methoxyphenyl)methyl]-4-oxo-1-phenylpyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-6-carboxamide847021-87-8C₃₀H₃₁N₅O₃

$2-[4-(2-{2,4-Dioxo-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(13),5,7,9,11-pentaen-3-yl}ethyl)piperazin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide chemical structure, C30H31N5O3, CAS 2548997-33-5$

2-[4-(2-{2,4-Dioxo-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(13),5,7,9,11-pentaen-3-yl}ethyl)piperazin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide2548997-33-5C₃₀H₃₁N₅O₃

Frequently asked questions

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

What is Risimtinib?

Risimtinib is a chemical substance with the molecular formula C30H31N5O3 and a molar mass of 509.61 g/mol. Its CAS registry number is 2126751-11-7. The IUPAC name is 6-[[2-[[4-[(3S,5R)-3,5-dimethylpiperazin-1-yl]benzoyl]amino]-4-pyridinyl]oxy]-N-methylnaphthalene-1-carboxamide.

What is the CAS number of Risimtinib?

The CAS registry number of Risimtinib is 2126751-11-7.

What is the molecular formula and weight of Risimtinib?

The molecular formula of Risimtinib is C30H31N5O3 and its molar mass is 509.61 g/mol.

What is Risimtinib used for?

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

Is Risimtinib hazardous?

No GHS hazard classification for Risimtinib 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 Risimtinib?

Risimtinib is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Risimtinib?

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

What is the price of Risimtinib?

Suppliers quote Risimtinib 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 Risimtinib

Risimtinib

Key facts

What is Risimtinib?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

Risimtinib suppliers

Risimtinib price

Uses and applications

Industries and functions

Regulatory status

HS code and trade data

Global trade

Frequently asked questions

What is Risimtinib?

What is the CAS number of Risimtinib?

What is the molecular formula and weight of Risimtinib?

What is Risimtinib used for?

Is Risimtinib hazardous?

What is the HS code of Risimtinib?

Where can I buy Risimtinib?

What is the price of Risimtinib?

Guides for buyers

Get quotes for Risimtinib

Key facts

What is Risimtinib?

Identifiers

Synonyms

Physical and chemical properties

Physical and chemical properties

Computed descriptors

Murcko scaffold

Safety and hazards

Risimtinib suppliers

Risimtinib 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 Risimtinib?

What is the CAS number of Risimtinib?

What is the molecular formula and weight of Risimtinib?

What is Risimtinib used for?

Is Risimtinib hazardous?

What is the HS code of Risimtinib?

Where can I buy Risimtinib?

What is the price of Risimtinib?

Guides for buyers

Get quotes for Risimtinib