N-[(3S,5S)-1-(5-methylthiophene-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(5-methylthiophene-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
N-[(3S,5S)-1-(5-methylthiophene-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide
Compound characteristics
| Compound ID: | SB18-0895 |
| Compound Name: | N-[(3S,5S)-1-(5-methylthiophene-2-carbonyl)-5-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C19 H21 N5 O3 S2 |
| Smiles: | Cc1ccc(C(N2C[C@H](C[C@H]2c2nc(c3ccccc3)n[nH]2)NS(C)(=O)=O)=O)s1 |
| Stereo: | ABSOLUTE |
| logP: | 2.9832 |
| logD: | 2.977 |
| logSw: | -3.3259 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.134 |
| InChI Key: | HEXMORHCBIGPDC-LSDHHAIUSA-N |