{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(oxan-4-yl)methanone
Chemical Structure Depiction of
{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(oxan-4-yl)methanone
{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(oxan-4-yl)methanone
Compound characteristics
| Compound ID: | P930-5536 |
| Compound Name: | {(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}(oxan-4-yl)methanone |
| Molecular Weight: | 344.39 |
| Molecular Formula: | C18 H21 F N4 O2 |
| Smiles: | C1C[C@@H](c2nnc(c3ccc(cc3)F)[nH]2)N(C1)C(C1CCOCC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8154 |
| logD: | 1.7798 |
| logSw: | -2.2348 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.561 |
| InChI Key: | QHIMPTZLLBDLTG-HNNXBMFYSA-N |