2-cyclohexyl-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-cyclohexyl-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one
2-cyclohexyl-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | P930-5549 |
| Compound Name: | 2-cyclohexyl-1-{(2S)-2-[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C20 H25 F N4 O |
| Smiles: | C1CCC(CC1)CC(N1CCC[C@H]1c1nnc(c2ccc(cc2)F)[nH]1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.6709 |
| logD: | 3.6354 |
| logSw: | -3.9124 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.125 |
| InChI Key: | UHMJTHBOPYCPMI-KRWDZBQOSA-N |