N-[3-(dimethylamino)propyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-[3-(dimethylamino)propyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-[3-(dimethylamino)propyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
Compound ID: | C097-0094 |
Compound Name: | N-[3-(dimethylamino)propyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
Molecular Weight: | 333.31 |
Molecular Formula: | C14 H18 F3 N3 O3 |
Smiles: | CN(C)CCCNC(NC1(C(F)(F)F)Oc2ccccc2O1)=O |
Stereo: | ACHIRAL |
logP: | 1.7682 |
logD: | 1.7682 |
logSw: | -2.184 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 52.934 |
InChI Key: | GUTWOWUBJDRVEH-UHFFFAOYSA-N |