3-{[1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole
3-{[1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-3053 |
| Compound Name: | 3-{[1-(1-ethyl-1H-pyrazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4-(propan-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 352.46 |
| Molecular Formula: | C15 H24 N6 O2 S |
| Smiles: | CCn1cc(cn1)S(N1CCC(Cc2nncn2C(C)C)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6391 |
| logD: | 0.6378 |
| logSw: | -1.4337 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.874 |
| InChI Key: | QHKPWDUCIMGOKF-ZDUSSCGKSA-N |