2-(4-chlorophenyl)-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-chlorophenyl)-1-[5-{[(4-fluorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]ethan-1-one
2-(4-chlorophenyl)-1-[5-{[(4-fluorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | D331-0152 |
| Compound Name: | 2-(4-chlorophenyl)-1-[5-{[(4-fluorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]ethan-1-one |
| Molecular Weight: | 410.83 |
| Molecular Formula: | C21 H16 Cl F N4 O2 |
| Smiles: | C(C(n1c(NCc2ccc(cc2)F)nc(c2ccco2)n1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1004 |
| logD: | 4.0927 |
| logSw: | -4.5464 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.278 |
| InChI Key: | CVOSGXQAQSTYEL-UHFFFAOYSA-N |