{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(3-methylphenyl)methanone
Chemical Structure Depiction of
{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(3-methylphenyl)methanone
{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(3-methylphenyl)methanone
Compound characteristics
| Compound ID: | P930-5479 |
| Compound Name: | {(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(3-methylphenyl)methanone |
| Molecular Weight: | 350.39 |
| Molecular Formula: | C20 H19 F N4 O |
| Smiles: | Cc1cccc(c1)C(N1CCC[C@H]1c1nnc(c2ccc(cc2)F)[nH]1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.0369 |
| logD: | 3.0013 |
| logSw: | -3.1604 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.46 |
| InChI Key: | AEYDYCQMGSINJH-KRWDZBQOSA-N |