4-benzyl-3-{2-[1-(5-fluoro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-benzyl-3-{2-[1-(5-fluoro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
4-benzyl-3-{2-[1-(5-fluoro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | SD73-0531 |
| Compound Name: | 4-benzyl-3-{2-[1-(5-fluoro-2-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4H-1,2,4-triazole |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C22 H25 F N4 O2 S |
| Smiles: | Cc1ccc(cc1S(N1CCCC1CCc1nncn1Cc1ccccc1)(=O)=O)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.364 |
| logD: | 3.364 |
| logSw: | -3.5157 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.799 |
| InChI Key: | RDGPEUHAMLDQHY-HXUWFJFHSA-N |