3-[1-(methanesulfonyl)pyrrolidin-2-yl]-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[1-(methanesulfonyl)pyrrolidin-2-yl]-4-phenyl-4H-1,2,4-triazole
3-[1-(methanesulfonyl)pyrrolidin-2-yl]-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | S845-0228 |
| Compound Name: | 3-[1-(methanesulfonyl)pyrrolidin-2-yl]-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 292.36 |
| Molecular Formula: | C13 H16 N4 O2 S |
| Smiles: | CS(N1CCCC1c1nncn1c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7278 |
| logD: | 0.7271 |
| logSw: | -1.8779 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.094 |
| InChI Key: | UWXXZNVJXZRMJA-LBPRGKRZSA-N |