N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y042-6774 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide |
| Molecular Weight: | 355.46 |
| Molecular Formula: | C18 H21 N5 O S |
| Smiles: | CSCC[C@@H](c1nc2ccccc2[nH]1)NC(c1c2CCCc2[nH]n1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3979 |
| logD: | 2.3967 |
| logSw: | -2.6146 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.892 |
| InChI Key: | YSSZHPSBVIHLHQ-HNNXBMFYSA-N |