2-(4-fluorophenoxy)-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenoxy)-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one
2-(4-fluorophenoxy)-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | P930-5507 |
| Compound Name: | 2-(4-fluorophenoxy)-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 384.38 |
| Molecular Formula: | C20 H18 F2 N4 O2 |
| Smiles: | C1C[C@@H](c2nnc(c3ccc(cc3)F)[nH]2)N(C1)C(COc1ccc(cc1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.5985 |
| logD: | 2.563 |
| logSw: | -2.8814 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.432 |
| InChI Key: | HLESTQWSQDZHFG-KRWDZBQOSA-N |