N-[1-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | 2628-3175 |
| Compound Name: | N-[1-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide |
| Molecular Weight: | 480.9 |
| Molecular Formula: | C25 H21 Cl N2 O6 |
| Smiles: | COc1ccc(c(c1)OC)NC(/C(=C\c1ccc2c(c1)OCO2)NC(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5706 |
| logD: | 4.3567 |
| logSw: | -4.6828 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.846 |
| InChI Key: | IKANJVWDCYCPKG-UHFFFAOYSA-N |