N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1-methyl-1H-indole-5-carboxamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1-methyl-1H-indole-5-carboxamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1-methyl-1H-indole-5-carboxamide
Compound characteristics
| Compound ID: | Y042-6757 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1-methyl-1H-indole-5-carboxamide |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C21 H22 N4 O S |
| Smiles: | Cn1ccc2cc(ccc12)C(N[C@@H](CCSC)c1nc2ccccc2[nH]1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.5358 |
| logD: | 3.5356 |
| logSw: | -3.8299 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.24 |
| InChI Key: | KKQNJQWTKSPYSY-SFHVURJKSA-N |