Products 3059496-10-2
CAS 3059496-10-2 is the registry number for KRAS inhibitor-38. Offered by: MedChemExpress. Available pack sizes: Get quote.
1-[(2R)-2-chloro-2-fluoroacetyl]-4-fluoro-N-[(2S)-1-[[(7S,13S)-20-[2-[(1S)-1-methoxyethyl]-5-morpholin-4-yl-3-pyridinyl]-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,30,31-tetrazahexacyclo[23.3.1.12,5.19,13.019,27.021,26]hentriaconta-1(29),2,5(31),19,25,27-hexaen-7-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylpiperidine-4-carboxamide (CAS 3059496-10-2) is a chemical compound with the molecular formula C53H68ClF2N9O8S and a molecular weight of 1064.7 g/mol. IUPAC name: 1-[(2R)-2-chloro-2-fluoroacetyl]-4-fluoro-N-[(2S)-1-[[(7S,13S)-20-[2-[(1S)-1-methoxyethyl]-5-morpholin-4-yl-3-pyridinyl]-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,30,31-tetrazahexacyclo[23.3.1.12,5.19,13.019,27.021,26]hentriaconta-1(29),2,5(31),19,25,27-hexaen-7-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylpiperidine-4-carboxamide. InChIKey: JAPAXSDAYQBFIJ-YUBGLVCHSA-N.
| Molecular formula | C53H68ClF2N9O8S |
|---|---|
| Molecular weight | 1064.7 g/mol |
| IUPAC name | 1-[(2R)-2-chloro-2-fluoroacetyl]-4-fluoro-N-[(2S)-1-[[(7S,13S)-20-[2-[(1S)-1-methoxyethyl]-5-morpholin-4-yl-3-pyridinyl]-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,30,31-tetrazahexacyclo[23.3.1.12,5.19,13.019,27.021,26]hentriaconta-1(29),2,5(31),19,25,27-hexaen-7-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylpiperidine-4-carboxamide |
| InChIKey | JAPAXSDAYQBFIJ-YUBGLVCHSA-N |
| SMILES | C[C@@H](C1=C(C=C(C=N1)N2CCOCC2)C3=C4CC(COC(=O)[C@@H]5CCCN(N5)C(=O)[C@H](CC6=NC(=CS6)C7=CC8=C(C4=C7)N3CCC8)NC(=O)[C@H](C(C)C)N(C)C(=O)C9(CCN(CC9)C(=O)[C@H](F)Cl)F)(C)C)OC |
Computed by PubChem (NCBI)
Synonyms:
KRAS inhibitor-38