N-[(4-methylphenyl)methyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-[(4-methylphenyl)methyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | 6594-0125 |
| Compound Name: | N-[(4-methylphenyl)methyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 352.31 |
| Molecular Formula: | C17 H15 F3 N2 O3 |
| Smiles: | Cc1ccc(CNC(NC2(C(F)(F)F)Oc3ccccc3O2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6076 |
| logD: | 3.3754 |
| logSw: | -3.7655 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.955 |
| InChI Key: | ASBJUHHDYKTMKH-UHFFFAOYSA-N |