N-[2-(dimethylamino)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-[2-(dimethylamino)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | C097-0095 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 319.28 |
| Molecular Formula: | C13 H16 F3 N3 O3 |
| Smiles: | CN(C)CCNC(NC1(C(F)(F)F)Oc2ccccc2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7619 |
| logD: | 1.7619 |
| logSw: | -2.155 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.934 |
| InChI Key: | ABBFRYRALCCFJO-UHFFFAOYSA-N |