3-(4-fluorophenyl)-5-{(2S)-1-[(2-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4-fluorophenyl)-5-{(2S)-1-[(2-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole
3-(4-fluorophenyl)-5-{(2S)-1-[(2-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P930-5650 |
| Compound Name: | 3-(4-fluorophenyl)-5-{(2S)-1-[(2-fluorophenyl)methanesulfonyl]pyrrolidin-2-yl}-4H-1,2,4-triazole |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C19 H18 F2 N4 O2 S |
| Smiles: | C1C[C@@H](c2nnc(c3ccc(cc3)F)[nH]2)N(C1)S(Cc1ccccc1F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9199 |
| logD: | 2.884 |
| logSw: | -3.3977 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.194 |
| InChI Key: | IXVMSIWCTHRBHZ-KRWDZBQOSA-N |