N-(4-{5-(2-fluorophenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)-N'-(2-methylphenyl)urea
Chemical Structure Depiction of
N-(4-{5-(2-fluorophenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)-N'-(2-methylphenyl)urea
N-(4-{5-(2-fluorophenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)-N'-(2-methylphenyl)urea
Compound characteristics
| Compound ID: | V014-1314 |
| Compound Name: | N-(4-{5-(2-fluorophenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)-N'-(2-methylphenyl)urea |
| Molecular Weight: | 537.59 |
| Molecular Formula: | C31 H28 F N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1NC(Nc1ccc(cc1)n1c(c2ccccc2F)nc(n1)OCCc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.829 |
| logD: | 6.829 |
| logSw: | -5.7468 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.985 |
| InChI Key: | BBMNBCVJSXAUHI-UHFFFAOYSA-N |