N-butyl-N-phenyl-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-butyl-N-phenyl-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-butyl-N-phenyl-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
Compound ID: | C097-0126 |
Compound Name: | N-butyl-N-phenyl-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
Molecular Weight: | 380.37 |
Molecular Formula: | C19 H19 F3 N2 O3 |
Smiles: | CCCCN(C(NC1(C(F)(F)F)Oc2ccccc2O1)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 5.2343 |
logD: | 4.8989 |
logSw: | -5.0236 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.752 |
InChI Key: | IFBNVGFQXHCMBR-UHFFFAOYSA-N |