N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)propanamide
Chemical Structure Depiction of
N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)propanamide
N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y043-5787 |
| Compound Name: | N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-(4-chlorophenyl)-3-(1H-pyrrol-1-yl)propanamide |
| Molecular Weight: | 453.01 |
| Molecular Formula: | C24 H25 Cl N4 O S |
| Smiles: | CSCC[C@@H](c1nc2ccccc2[nH]1)NC(CC(c1ccc(cc1)[Cl])n1cccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0163 |
| logD: | 5.0156 |
| logSw: | -5.3 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.882 |
| InChI Key: | HVFDFJKAJAMGAW-HMTLIYDFSA-N |