N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | C097-0113 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 356.34 |
| Molecular Formula: | C17 H19 F3 N2 O3 |
| Smiles: | C1CCC(CCNC(NC2(C(F)(F)F)Oc3ccccc3O2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.7301 |
| logD: | 3.3292 |
| logSw: | -4.2048 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.989 |
| InChI Key: | AAUPSWUWMMXILS-UHFFFAOYSA-N |