3-{2-[1-(methanesulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{2-[1-(methanesulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole
3-{2-[1-(methanesulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | SD73-0436 |
| Compound Name: | 3-{2-[1-(methanesulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C15 H20 N4 O2 S |
| Smiles: | CS(N1CCCC1CCc1nncn1c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2736 |
| logD: | 1.2736 |
| logSw: | -2.0688 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.022 |
| InChI Key: | DCGJGPLISBTTPJ-CQSZACIVSA-N |