N-(3-chlorophenyl)-N'-(4-{5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)urea
Chemical Structure Depiction of
N-(3-chlorophenyl)-N'-(4-{5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)urea
N-(3-chlorophenyl)-N'-(4-{5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)urea
Compound characteristics
| Compound ID: | V006-1896 |
| Compound Name: | N-(3-chlorophenyl)-N'-(4-{5-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)ethoxy]-1H-1,2,4-triazol-1-yl}phenyl)urea |
| Molecular Weight: | 570.05 |
| Molecular Formula: | C31 H28 Cl N5 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCOc2nc(c3ccc(cc3)OC)n(c3ccc(cc3)NC(Nc3cccc(c3)[Cl])=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.9972 |
| logD: | 7.9972 |
| logSw: | -6.4937 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.227 |
| InChI Key: | LKSBADWALKGZIY-UHFFFAOYSA-N |