N-(3-chloro-4-methylphenyl)-N~3~-(2-phenyl-1H-benzimidazole-5-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-N~3~-(2-phenyl-1H-benzimidazole-5-sulfonyl)-beta-alaninamide
N-(3-chloro-4-methylphenyl)-N~3~-(2-phenyl-1H-benzimidazole-5-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | E511-4555 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-N~3~-(2-phenyl-1H-benzimidazole-5-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 468.96 |
| Molecular Formula: | C23 H21 Cl N4 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CCNS(c1ccc2c(c1)nc(c1ccccc1)[nH]2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.209 |
| logD: | 5.2001 |
| logSw: | -5.6485 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.007 |
| InChI Key: | QKIILVOYGAVQKI-UHFFFAOYSA-N |