Structure of Sotorasib CAS 2296729-00-3

Sotorasib CAS 2296729-00-3

Identification

CAS Number

2296729-00-3

Name

Sotorasib

Synonyms

2252403-56-6 [RN]
4-[(2S)-4-Acryloyl-2-methyl-1-piperazinyl]-6-fluor-7-(2-fluor-6-hydroxyphenyl)-1-(2-isopropyl-4-methyl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2(1H)-on [German] [ACD/IUPAC Name]
4-[(2S)-4-Acryloyl-2-methyl-1-piperazinyl]-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(2-isopropyl-4-methyl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2(1H)-one [ACD/IUPAC Name]
4-[(2S)-4-Acryloyl-2-méthyl-1-pipérazinyl]-6-fluoro-7-(2-fluoro-6-hydroxyphényl)-1-(2-isopropyl-4-méthyl-3-pyridinyl)pyrido[2,3-d]pyrimidin-2(1H)-one [French] [ACD/IUPAC Name]
6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(2-isopropyl-4-methylpyridin-3-yl)-4-[(2S)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-2-one
6-Fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-[4-methyl-2-(1-methylethyl)-3-pyridinyl]-4-[(2S)-2-methyl-4-(1-oxo-2-propen-1-yl)-1-piperazinyl]pyrido[2,3-d]pyrimidin-2(1H)-one
6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-[4-methyl-2-(propan-2-yl)pyridin-3-yl]-4-[(2S)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl]-1H,2H-pyrido[2,3-d]pyrimidin-2-one
Lumakras [Trade name]
Pyrido[2,3-d]pyrimidin-2(1H)-one, 6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-[4-methyl-2-(1-methylethyl)-3-pyridinyl]-4-[(2S)-2-methyl-4-(1-oxo-2-propen-1-yl)-1-piperazinyl]- [ACD/Index Name]
sotorasib [USAN]
(1R)-4-((S)-4-Acryloyl-2-methylpiperazin-1-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(2-isopropyl-4-methylpyridin-3-yl)pyrido[2,3-d]pyrimidin-2(1H)-one
2296729-00-3 [RN]
2296729-00-3 (racemate)
2296729-66-1 [RN]
4-((S)-4-acryloyl-2-methylpiperazin-1-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(2-isopropyl-4-methylpyridin-3-yl)pyrido[2,3-d]pyrimidin-2(1H)-one
6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-[4-methyl-2-(propan-2-yl)pyridin-3-yl]-4-[(2S)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-2(1H)-one
AMG 510
AMG510
AMG-510
AMG-510 racemate
BS-16684
KRAS
MFCD32062763
sotorasib; sotorasibum

SMILES

CC1=CC=NC(C(C)C)=C1N1C2N=C(C3C(O)=CC=CC=3F)C(F)=CC=2C(=NC1=O)N1CCN(C[C@@H]1C)C(=O)C=C

StdInChI

InChI=1S/C30H30F2N6O3/c1-6-23(40)36-12-13-37(18(5)15-36)28-19-14-21(32)26(24-20(31)8-7-9-22(24)39)34-29(19)38(30(41)35-28)27-17(4)10-11-33-25(27)16(2)3/h6-11,14,16,18,39H,1,12-13,15H2,2-5H3/t18-/m0/s1

StdInChIKey

NXQKSXLFSAEQCZ-SFHVURJKSA-N

Molecular Formula

C30H30F2N6O3

Molecular Weight

560.594

MDL Number

MFCD32880274

Properties

Appearance

Safety Data

Symbol

Signal Word

Warning

WGK Germany

3

MSDS Download

Specifications and Other Information of Our

Identification Methods

Purity

Productivity

Known Application

Sotorasib CAS 2296729-00-3 is a selective covalent inhibitor of KRAS G12C for the treatment of patients with advanced KRAS G12C mutated non-small cell lung cancer (NSCLC) who have received prior systemic therapy.

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