N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | 2628-3178 |
| Compound Name: | N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide |
| Molecular Weight: | 480.9 |
| Molecular Formula: | C25 H21 Cl N2 O6 |
| Smiles: | COc1ccc(cc1OC)NC(/C(=C\c1ccc2c(c1)OCO2)NC(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1621 |
| logD: | 3.8039 |
| logSw: | -4.4481 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.631 |
| InChI Key: | TULXQZBGALXONC-UHFFFAOYSA-N |