N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide--hydrogen chloride (1/2)
Chemical Structure Depiction of
N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide--hydrogen chloride (1/2)
N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | SB18-0982 |
| Compound Name: | N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide--hydrogen chloride (1/2) |
| Molecular Weight: | 380.29 |
| Molecular Formula: | C13 H17 N5 O2 S |
| Salt: | 2HCl |
| Smiles: | [H]N1C[C@H](C[C@H]1c1nc(c2ccccc2)n[nH]1)NS(C)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4723 |
| logD: | 0.4657 |
| logSw: | -2.1278 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.076 |
| InChI Key: | JQPNUDIRDSYBNP-QWRGUYRKSA-N |