N-(2-methoxyphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-(2-methoxyphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-(2-methoxyphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | C097-0025 |
| Compound Name: | N-(2-methoxyphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 354.28 |
| Molecular Formula: | C16 H13 F3 N2 O4 |
| Smiles: | COc1ccccc1NC(NC1(C(F)(F)F)Oc2ccccc2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7217 |
| logD: | 3.556 |
| logSw: | -4.2692 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.565 |
| InChI Key: | BXMMXWKDPSEQKN-UHFFFAOYSA-N |