4-benzyl-3-{2-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-benzyl-3-{2-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
4-benzyl-3-{2-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | SD73-0572 |
| Compound Name: | 4-benzyl-3-{2-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole |
| Molecular Weight: | 410.54 |
| Molecular Formula: | C22 H26 N4 O2 S |
| Smiles: | Cc1cccc(c1)S(N1CCCC1CCc1nncn1Cc1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.36 |
| logD: | 3.36 |
| logSw: | -3.5678 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.799 |
| InChI Key: | RXFMRNDVMBDNFP-HXUWFJFHSA-N |