HIT ID: HIT218848794
Cas No: 2836273-61-9
分子式: C45H51F3N8O7
分子量: 872.947
常用名: PROTAC SOS1 degrader-5
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-[(1-{[(4-{[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]amino}-7-methoxy-2-methylquinazolin-6-yl)oxy]methyl}cyclopropyl)methyl]-7-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}-N-methylheptanamide
IUPAC: N-[(1-{[(4-{[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]amino}-7-methoxy-2-methylquinazolin-6-yl)oxy]methyl}cyclopropyl)methyl]-7-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}-N-methylheptanamide
SMILES: COc1cc2nc(C)nc(N[C@H](C)c3cc(N)cc(c3)C(F)(F)F)c2cc1OCC1(CN(C)C(=O)CCCCCCNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1
SMILES: COc1cc2nc(C)nc(N[C@H](C)c3cc(N)cc(c3)C(F)(F)F)c2cc1OCC1(CN(C)C(=O)CCCCCCNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1
InChI key: WLWKNXUSLSOAGM-HSGLFRJESA-N
