N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-methylphenyl)urea
Chemical Structure Depiction of
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-methylphenyl)urea
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-methylphenyl)urea
Compound characteristics
| Compound ID: | C097-0333 |
| Compound Name: | N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-methylphenyl)urea |
| Molecular Weight: | 407.17 |
| Molecular Formula: | C16 H11 Cl2 F3 N2 O3 |
| Smiles: | Cc1cccc(c1)NC(NC1(C(F)(F)F)Oc2cc(c(cc2O1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5863 |
| logD: | 5.2976 |
| logSw: | -5.9726 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.633 |
| InChI Key: | BHLGJOBKKMPYTQ-UHFFFAOYSA-N |