{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}[4-(propan-2-yl)phenyl]methanone
Chemical Structure Depiction of
{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}[4-(propan-2-yl)phenyl]methanone
{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}[4-(propan-2-yl)phenyl]methanone
Compound characteristics
| Compound ID: | P930-5486 |
| Compound Name: | {(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}[4-(propan-2-yl)phenyl]methanone |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C22 H23 F N4 O |
| Smiles: | CC(C)c1ccc(cc1)C(N1CCC[C@H]1c1nnc(c2ccc(cc2)F)[nH]1)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.0881 |
| logD: | 4.0525 |
| logSw: | -4.1283 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.46 |
| InChI Key: | VHVAETLMLKEXPJ-IBGZPJMESA-N |