N-(3-chlorophenyl)-N'-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
Chemical Structure Depiction of
N-(3-chlorophenyl)-N'-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
N-(3-chlorophenyl)-N'-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
Compound characteristics
| Compound ID: | V012-6858 |
| Compound Name: | N-(3-chlorophenyl)-N'-(4-{3-[(4-fluorophenyl)methoxy]-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea |
| Molecular Weight: | 581.96 |
| Molecular Formula: | C29 H20 Cl F4 N5 O2 |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)F)Oc1nc(c2ccc(cc2)C(F)(F)F)n(c2ccc(cc2)NC(Nc2cccc(c2)[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 8.6164 |
| logD: | 8.6164 |
| logSw: | -6.7976 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.221 |
| InChI Key: | HKMJQIRITPFGBZ-UHFFFAOYSA-N |