N-[3-(1H-benzimidazol-2-yl)propyl]-1-oxo-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
N-[3-(1H-benzimidazol-2-yl)propyl]-1-oxo-1H-2-benzothiopyran-3-carboxamide
N-[3-(1H-benzimidazol-2-yl)propyl]-1-oxo-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
| Compound ID: | Y043-8258 |
| Compound Name: | N-[3-(1H-benzimidazol-2-yl)propyl]-1-oxo-1H-2-benzothiopyran-3-carboxamide |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C20 H17 N3 O2 S |
| Smiles: | C(Cc1nc2ccccc2[nH]1)CNC(C1=Cc2ccccc2C(=O)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4234 |
| logD: | 3.4157 |
| logSw: | -4.013 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.768 |
| InChI Key: | BDIYSVGHUYGBPP-UHFFFAOYSA-N |