3-[1-(benzenesulfonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[1-(benzenesulfonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole
3-[1-(benzenesulfonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | S845-0288 |
| Compound Name: | 3-[1-(benzenesulfonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C15 H20 N4 O2 S |
| Smiles: | CC(C)n1cnnc1C1CCCN1S(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.575 |
| logD: | 1.5718 |
| logSw: | -2.1625 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.934 |
| InChI Key: | ICHCDXJZBSBCBS-AWEZNQCLSA-N |