N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(pyrazine-2-carbonyl)pyrrolidin-3-yl]methanesulfonamide
Chemical Structure Depiction of
N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(pyrazine-2-carbonyl)pyrrolidin-3-yl]methanesulfonamide
N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(pyrazine-2-carbonyl)pyrrolidin-3-yl]methanesulfonamide
Compound characteristics
| Compound ID: | SB18-1079 |
| Compound Name: | N-[(3S,5S)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(pyrazine-2-carbonyl)pyrrolidin-3-yl]methanesulfonamide |
| Molecular Weight: | 413.46 |
| Molecular Formula: | C18 H19 N7 O3 S |
| Smiles: | CS(N[C@H]1C[C@@H](c2nc(c3ccccc3)n[nH]2)N(C1)C(c1cnccn1)=O)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.6519 |
| logD: | 0.6457 |
| logSw: | -1.9162 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.682 |
| InChI Key: | CYGGHSBTLWZEIO-DZGCQCFKSA-N |