HIT ID: HIT212672574
Cas No: 2097853-86-4
分子式: C20H21Cl2N7O3
分子量: 478.33
常用名: MLT-747
氢键受体数 (HBA): 6
氢键供体数 (HBD): 2
LogP: 2.310969
IUPAC: 1-[5-chloro-6-(pyrrolidine-1-carbonyl)pyridin-3-yl]-3-{2-chloro-7-[(1S)-1-methoxyethyl]pyrazolo[1,5-a]pyrimidin-6-yl}urea
IUPAC: 1-[5-chloro-6-(pyrrolidine-1-carbonyl)pyridin-3-yl]-3-{2-chloro-7-[(1S)-1-methoxyethyl]pyrazolo[1,5-a]pyrimidin-6-yl}urea
SMILES: CO[C@@H](C)c1c(NC(=O)Nc2cnc(C(=O)N3CCCC3)c(Cl)c2)cnc2cc(Cl)nn12
SMILES: CO[C@@H](C)c1c(NC(=O)Nc2cnc(C(=O)N3CCCC3)c(Cl)c2)cnc2cc(Cl)nn12
InChI key: OJTGJRAKRGEDPI-NSHDSACASA-N
