3-(4-fluorophenyl)-5-{(2S)-1-[3-(trifluoromethyl)benzene-1-sulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4-fluorophenyl)-5-{(2S)-1-[3-(trifluoromethyl)benzene-1-sulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole
3-(4-fluorophenyl)-5-{(2S)-1-[3-(trifluoromethyl)benzene-1-sulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P930-5515 |
| Compound Name: | 3-(4-fluorophenyl)-5-{(2S)-1-[3-(trifluoromethyl)benzene-1-sulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole |
| Molecular Weight: | 440.42 |
| Molecular Formula: | C19 H16 F4 N4 O2 S |
| Smiles: | C1C[C@@H](c2nnc(c3ccc(cc3)F)[nH]2)N(C1)S(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.6091 |
| logD: | 3.5735 |
| logSw: | -3.9132 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.299 |
| InChI Key: | RZCHNHXLYLHBRO-INIZCTEOSA-N |