L-770644 dihydrochloride
HIT214317635
sdf文件结构编辑类似物检索
HIT ID: HIT214317635
Cas No: 182251-68-9
分子式: C30H38ClN7O4S
分子量: 628.19
常用名: L-770644 dihydrochloride
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-[4-(3-cyclopentylpropyl)-5-oxo-4,5-dihydro-1H-1,2,3,4-tetrazol-1-yl]-N-[4-(2-{[(2R)-2-hydroxy-2-(pyridin-3-yl)ethyl]amino}ethyl)phenyl]benzene-1-sulfonamide hydrochloride
IUPAC: 4-[4-(3-cyclopentylpropyl)-5-oxo-4,5-dihydro-1H-1,2,3,4-tetrazol-1-yl]-N-[4-(2-{[(2R)-2-hydroxy-2-(pyridin-3-yl)ethyl]amino}ethyl)phenyl]benzene-1-sulfonamide hydrochloride
SMILES: Cl.O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(cc2)-n2nnn(CCCC3CCCC3)c2=O)cc1)c1cccnc1
SMILES: Cl.O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(cc2)-n2nnn(CCCC3CCCC3)c2=O)cc1)c1cccnc1
InChI key: FFUMSRJGSDFOIS-JMAPEOGHSA-N
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