N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[4-(trifluoromethoxy)phenyl]urea
Chemical Structure Depiction of
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[4-(trifluoromethoxy)phenyl]urea
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[4-(trifluoromethoxy)phenyl]urea
Compound characteristics
| Compound ID: | C097-0344 |
| Compound Name: | N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-[4-(trifluoromethoxy)phenyl]urea |
| Molecular Weight: | 477.14 |
| Molecular Formula: | C16 H8 Cl2 F6 N2 O4 |
| Smiles: | c1cc(ccc1NC(NC1(C(F)(F)F)Oc2cc(c(cc2O1)[Cl])[Cl])=O)OC(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.4176 |
| logD: | 5.6428 |
| logSw: | -6.6278 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.57 |
| InChI Key: | IVCVGXLPXBKHFF-UHFFFAOYSA-N |