2-(3-fluorophenyl)-1-(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(3-fluorophenyl)-1-(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)ethan-1-one
2-(3-fluorophenyl)-1-(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | P937-3171 |
| Compound Name: | 2-(3-fluorophenyl)-1-(3-{[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C20 H20 F N5 O |
| Smiles: | C1CN(CC1Cc1nnc(c2cccnc2)[nH]1)C(Cc1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2283 |
| logD: | 2.1238 |
| logSw: | -2.3866 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.68 |
| InChI Key: | HXILMAOLQIBWLJ-HNNXBMFYSA-N |