N-(2-methylphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
Chemical Structure Depiction of
N-(2-methylphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
N-(2-methylphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
Compound characteristics
| Compound ID: | V014-5079 |
| Compound Name: | N-(2-methylphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea |
| Molecular Weight: | 509.53 |
| Molecular Formula: | C27 H26 F3 N5 O2 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2ccc(cc2)C(F)(F)F)n(c2ccc(cc2)NC(Nc2ccccc2C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.3475 |
| logD: | 7.3475 |
| logSw: | -5.8504 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.794 |
| InChI Key: | RKRULBNAFZAJDW-UHFFFAOYSA-N |