3-{[1-(ethanesulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[1-(ethanesulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole
3-{[1-(ethanesulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-3034 |
| Compound Name: | 3-{[1-(ethanesulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 286.39 |
| Molecular Formula: | C12 H22 N4 O2 S |
| Smiles: | CCS(N1CCC(Cc2nncn2C(C)C)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8361 |
| logD: | 0.8348 |
| logSw: | -1.3102 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.538 |
| InChI Key: | GWMLYGUEZZBNFC-NSHDSACASA-N |