N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(propan-2-yl)urea
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | C097-0389 |
| Compound Name: | N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(propan-2-yl)urea |
| Molecular Weight: | 359.13 |
| Molecular Formula: | C12 H11 Cl2 F3 N2 O3 |
| Smiles: | CC(C)NC(NC1(C(F)(F)F)Oc2cc(c(cc2O1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7438 |
| logD: | 3.4111 |
| logSw: | -4.1754 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.201 |
| InChI Key: | BDZQAWMLSLTWNR-UHFFFAOYSA-N |