3-{(2S)-1-[(3-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-5-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{(2S)-1-[(3-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-5-methyl-4H-1,2,4-triazole
3-{(2S)-1-[(3-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-5-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P930-0453 |
| Compound Name: | 3-{(2S)-1-[(3-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-5-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 324.37 |
| Molecular Formula: | C14 H17 F N4 O2 S |
| Smiles: | Cc1nnc([C@@H]2CCCN2S(Cc2cccc(c2)F)(=O)=O)[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 1.0332 |
| logD: | 1.0277 |
| logSw: | -2.232 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.078 |
| InChI Key: | VHHABRMBZPAKFI-ZDUSSCGKSA-N |