N-[1-(2H-1,3-benzodioxol-5-yl)-3-(5-chloro-2-methoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(5-chloro-2-methoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(5-chloro-2-methoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | 2628-3176 |
| Compound Name: | N-[1-(2H-1,3-benzodioxol-5-yl)-3-(5-chloro-2-methoxyanilino)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide |
| Molecular Weight: | 485.32 |
| Molecular Formula: | C24 H18 Cl2 N2 O5 |
| Smiles: | COc1ccc(cc1NC(/C(=C\c1ccc2c(c1)OCO2)NC(c1ccccc1[Cl])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0782 |
| logD: | 4.5136 |
| logSw: | -5.3047 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.302 |
| InChI Key: | UGCOZTNISFJFQI-UHFFFAOYSA-N |