N-[(3S,5S)-1-(3-methylbutanoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(3-methylbutanoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
N-[(3S,5S)-1-(3-methylbutanoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Compound characteristics
| Compound ID: | SB18-0924 |
| Compound Name: | N-[(3S,5S)-1-(3-methylbutanoyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C18 H25 N5 O3 S |
| Smiles: | CC(C)CC(N1C[C@H](C[C@H]1c1nc(c2ccccc2)n[nH]1)NS(C)(=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3264 |
| logD: | 2.3202 |
| logSw: | -2.7674 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.86 |
| InChI Key: | OLLYURWIFRXADY-LSDHHAIUSA-N |