N-[3-(1H-benzimidazol-2-yl)phenyl]butanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[3-(1H-benzimidazol-2-yl)phenyl]butanamide--hydrogen chloride (1/1)
N-[3-(1H-benzimidazol-2-yl)phenyl]butanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D685-0005 |
| Compound Name: | N-[3-(1H-benzimidazol-2-yl)phenyl]butanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 315.8 |
| Molecular Formula: | C17 H17 N3 O |
| Salt: | HCl |
| Smiles: | CCCC(Nc1cccc(c1)c1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0484 |
| logD: | 4.0478 |
| logSw: | -4.0877 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.407 |
| InChI Key: | PIOSDNGVTZWZHV-UHFFFAOYSA-N |