N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-methylpropyl)urea
Chemical Structure Depiction of
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-methylpropyl)urea
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-methylpropyl)urea
Compound characteristics
Compound ID: | C097-0244 |
Compound Name: | N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-methylpropyl)urea |
Molecular Weight: | 338.71 |
Molecular Formula: | C13 H14 Cl F3 N2 O3 |
Smiles: | CC(C)CNC(NC1(C(F)(F)F)Oc2ccc(cc2O1)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8672 |
logD: | 3.3919 |
logSw: | -4.3676 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 49.227 |
InChI Key: | LMGRJISKADTODA-ZDUSSCGKSA-N |