N-[(3S,5S)-1-[(2-methyl-1H-imidazol-1-yl)acetyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Chemical Structure Depiction of
N-[(3S,5S)-1-[(2-methyl-1H-imidazol-1-yl)acetyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
N-[(3S,5S)-1-[(2-methyl-1H-imidazol-1-yl)acetyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Compound characteristics
| Compound ID: | SB18-1128 |
| Compound Name: | N-[(3S,5S)-1-[(2-methyl-1H-imidazol-1-yl)acetyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C19 H23 N7 O3 S |
| Smiles: | Cc1nccn1CC(N1C[C@H](C[C@H]1c1nc(c2ccccc2)n[nH]1)NS(C)(=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.5151 |
| logD: | -0.51 |
| logSw: | -2.3622 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.147 |
| InChI Key: | YJHAWTPCBRCOTM-JKSUJKDBSA-N |