N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-{3-[(propan-2-yl)oxy]propyl}urea
Chemical Structure Depiction of
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-{3-[(propan-2-yl)oxy]propyl}urea
N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-{3-[(propan-2-yl)oxy]propyl}urea
Compound characteristics
| Compound ID: | C097-0395 |
| Compound Name: | N-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-{3-[(propan-2-yl)oxy]propyl}urea |
| Molecular Weight: | 417.21 |
| Molecular Formula: | C15 H17 Cl2 F3 N2 O4 |
| Smiles: | CC(C)OCCCNC(NC1(C(F)(F)F)Oc2cc(c(cc2O1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8512 |
| logD: | 3.2254 |
| logSw: | -4.2288 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.269 |
| InChI Key: | BJXDJECYTDWXPU-UHFFFAOYSA-N |