3-{2-[1-(4-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{2-[1-(4-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole
3-{2-[1-(4-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | SD73-0438 |
| Compound Name: | 3-{2-[1-(4-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]ethyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 400.47 |
| Molecular Formula: | C20 H21 F N4 O2 S |
| Smiles: | C1CC(CCc2nncn2c2ccccc2)N(C1)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9393 |
| logD: | 2.9392 |
| logSw: | -3.3743 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.258 |
| InChI Key: | JMPCDCJIYBFUBC-GOSISDBHSA-N |