N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide
Compound characteristics
| Compound ID: | Y042-6723 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C20 H24 N4 O S |
| Smiles: | C[C@@H](c1nc2ccccc2[nH]1)NC(CC1(CCSCC1)n1cccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9858 |
| logD: | 2.9852 |
| logSw: | -3.4036 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.659 |
| InChI Key: | OTJDHXFEDXXOSU-HNNXBMFYSA-N |