4-benzyl-3-{2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-benzyl-3-{2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
4-benzyl-3-{2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | SD73-0516 |
| Compound Name: | 4-benzyl-3-{2-[1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole |
| Molecular Weight: | 426.54 |
| Molecular Formula: | C22 H26 N4 O3 S |
| Smiles: | COc1ccc(cc1)S(N1CCCC1CCc1nncn1Cc1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9176 |
| logD: | 2.9176 |
| logSw: | -3.3338 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.343 |
| InChI Key: | KTFAKXMYZAQPGV-LJQANCHMSA-N |