HIT ID: HIT218903956
Cas No: 2366216-76-2
分子式: C37H39N7O
分子量: 597.767
常用名: JND4135
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-{2-[6-(4-aminophenyl)imidazo[1,2-a]pyrazin-3-yl]ethynyl}-2-methyl-N-{3-[(4-methylpiperazin-1-yl)methyl]-5-(propan-2-yl)phenyl}benzamide
IUPAC: 3-{2-[6-(4-aminophenyl)imidazo[1,2-a]pyrazin-3-yl]ethynyl}-2-methyl-N-{3-[(4-methylpiperazin-1-yl)methyl]-5-(propan-2-yl)phenyl}benzamide
SMILES: CC(C)c1cc(CN2CCN(C)CC2)cc(NC(=O)c2cccc(C#Cc3cnc4cnc(cn34)-c3ccc(N)cc3)c2C)c1
SMILES: CC(C)c1cc(CN2CCN(C)CC2)cc(NC(=O)c2cccc(C#Cc3cnc4cnc(cn34)-c3ccc(N)cc3)c2C)c1
InChI key: KDFREDAEEQQCFD-UHFFFAOYSA-N
