N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | C097-0114 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 412.36 |
| Molecular Formula: | C19 H19 F3 N2 O5 |
| Smiles: | COc1ccc(CCNC(NC2(C(F)(F)F)Oc3ccccc3O2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.8767 |
| logD: | 2.2169 |
| logSw: | -3.4594 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.057 |
| InChI Key: | GVPYEXIXGROYOZ-UHFFFAOYSA-N |