N-[(3S,5S)-1-(3-phenylpropyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(3-phenylpropyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
N-[(3S,5S)-1-(3-phenylpropyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Compound characteristics
| Compound ID: | SB18-1097 |
| Compound Name: | N-[(3S,5S)-1-(3-phenylpropyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C22 H27 N5 O2 S |
| Smiles: | CS(N[C@H]1C[C@@H](c2nc(c3ccccc3)n[nH]2)N(CCCc2ccccc2)C1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.4804 |
| logD: | 3.4742 |
| logSw: | -3.7882 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.344 |
| InChI Key: | DFMVHLRFFPJAPM-VQTJNVASSA-N |