4-benzyl-3-(2-{1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}ethyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-benzyl-3-(2-{1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}ethyl)-4H-1,2,4-triazole
4-benzyl-3-(2-{1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}ethyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | SD73-0569 |
| Compound Name: | 4-benzyl-3-(2-{1-[4-(propan-2-yl)benzene-1-sulfonyl]pyrrolidin-2-yl}ethyl)-4H-1,2,4-triazole |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C24 H30 N4 O2 S |
| Smiles: | CC(C)c1ccc(cc1)S(N1CCCC1CCc1nncn1Cc1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2734 |
| logD: | 4.2734 |
| logSw: | -4.1864 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.799 |
| InChI Key: | XZWCTXQANAAIQO-JOCHJYFZSA-N |