N-(4-methoxyphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
Chemical Structure Depiction of
N-(4-methoxyphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
N-(4-methoxyphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea
Compound characteristics
| Compound ID: | V014-5080 |
| Compound Name: | N-(4-methoxyphenyl)-N'-(4-{3-(2-methylpropoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)urea |
| Molecular Weight: | 525.53 |
| Molecular Formula: | C27 H26 F3 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2ccc(cc2)C(F)(F)F)n(c2ccc(cc2)NC(Nc2ccc(cc2)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.5341 |
| logD: | 7.5341 |
| logSw: | -5.8257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.036 |
| InChI Key: | ONOZHRFXVDSSES-UHFFFAOYSA-N |