2-(4-chlorophenoxy)-1-[5-{[(4-fluorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-[5-{[(4-fluorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]ethan-1-one
2-(4-chlorophenoxy)-1-[5-{[(4-fluorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | D331-0122 |
| Compound Name: | 2-(4-chlorophenoxy)-1-[5-{[(4-fluorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]ethan-1-one |
| Molecular Weight: | 426.83 |
| Molecular Formula: | C21 H16 Cl F N4 O3 |
| Smiles: | C(c1ccc(cc1)F)Nc1nc(c2ccco2)nn1C(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7917 |
| logD: | 3.7917 |
| logSw: | -4.4364 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.777 |
| InChI Key: | QYOYJPGMVXWYPU-UHFFFAOYSA-N |