HIT ID: HIT218850370
Cas No: 3027905-74-1
分子式: C37H50N8O4
分子量: 670.859
常用名: Antitumor agent-172
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-{2-[2-(2-aminoethyl)pyrrolidin-1-yl]-2-oxoethyl}-2-{3-[(3R)-3-{[cyclopropyl({[4-(1H-pyrazol-4-yl)phenyl]methyl})carbamoyl]amino}piperidin-1-yl]phenoxy}-2-methylpropanamide
IUPAC: N-{2-[2-(2-aminoethyl)pyrrolidin-1-yl]-2-oxoethyl}-2-{3-[(3R)-3-{[cyclopropyl({[4-(1H-pyrazol-4-yl)phenyl]methyl})carbamoyl]amino}piperidin-1-yl]phenoxy}-2-methylpropanamide
SMILES: CC(C)(Oc1cccc(c1)N1CCC[C@H](C1)NC(=O)N(Cc1ccc(cc1)-c1cn[nH]c1)C1CC1)C(=O)NCC(=O)N1CCCC1CCN
SMILES: CC(C)(Oc1cccc(c1)N1CCC[C@H](C1)NC(=O)N(Cc1ccc(cc1)-c1cn[nH]c1)C1CC1)C(=O)NCC(=O)N1CCCC1CCN
InChI key: PTWAMJRFMLXZPR-IDCGIGBZSA-N
