HIT ID: HIT100563142
Cas No: 1114628-25-9
分子式: C26H26ClN3O3
分子量: 463.96
常用名: CRM1-IN-3
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 6.608
IUPAC: 3-(4-chlorobenzamido)-4-[4-(2,5-dimethylphenyl)piperazin-1-yl]benzoic acid
IUPAC: 3-(4-chlorobenzamido)-4-[4-(2,5-dimethylphenyl)piperazin-1-yl]benzoic acid
SMILES: Cc1ccc(C)c(c1)N1CCN(CC1)c1ccc(cc1NC(=O)c1ccc(Cl)cc1)C(O)=O
SMILES: Cc1ccc(C)c(c1)N1CCN(CC1)c1ccc(cc1NC(=O)c1ccc(Cl)cc1)C(O)=O
InChI key: BQXRGKXBCYCKLD-UHFFFAOYSA-N