2-(4-fluorophenoxy)-1-{3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenoxy)-1-{3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one
2-(4-fluorophenoxy)-1-{3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | P937-3988 |
| Compound Name: | 2-(4-fluorophenoxy)-1-{3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 380.42 |
| Molecular Formula: | C21 H21 F N4 O2 |
| Smiles: | C1CN(CC1Cc1nnc(c2ccccc2)[nH]1)C(COc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8638 |
| logD: | 2.8282 |
| logSw: | -3.2761 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.662 |
| InChI Key: | GAVBSXOBBMVEKR-HNNXBMFYSA-N |