N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[(4-methylphenyl)methyl]urea
Chemical Structure Depiction of
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[(4-methylphenyl)methyl]urea
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[(4-methylphenyl)methyl]urea
Compound characteristics
| Compound ID: | C097-0405 |
| Compound Name: | N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[(4-methylphenyl)methyl]urea |
| Molecular Weight: | 421.2 |
| Molecular Formula: | C17 H13 Cl2 F3 N2 O3 |
| Smiles: | Cc1ccc(CNC(NC2(C(F)(F)F)Oc3cc(c(cc3O2)[Cl])[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8663 |
| logD: | 4.41 |
| logSw: | -5.0118 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.955 |
| InChI Key: | GMDZIRVTVLCIQG-UHFFFAOYSA-N |