Ro 22-3245
HIT212670252
sdf文件结构编辑类似物检索
HIT ID: HIT212670252
Cas No: 76988-39-1
分子式: C18H11Cl2N3
分子量: 340.21
常用名: Ro 22-3245
氢键受体数 (HBA): 3
氢键供体数 (HBD): 0
LogP: 4.7378182
IUPAC: 13-chloro-10-(2-chlorophenyl)-3,5,9-triazatricyclo[9.4.0.0^{2,7}]pentadeca-1(15),2,4,6,9,11,13-heptaene
IUPAC: 13-chloro-10-(2-chlorophenyl)-3,5,9-triazatricyclo[9.4.0.0^{2,7}]pentadeca-1(15),2,4,6,9,11,13-heptaene
SMILES: Clc1ccc-2c(c1)C(=NCc1cncnc-21)c1ccccc1Cl |c:8|
SMILES: Clc1ccc-2c(c1)C(=NCc1cncnc-21)c1ccccc1Cl |c:8|
InChI key: CLYXKIKVKJZIOF-UHFFFAOYSA-N
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