4-chloro-N-[1-(3,4-dimethoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-chloro-N-[1-(3,4-dimethoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
4-chloro-N-[1-(3,4-dimethoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2628-3251 |
| Compound Name: | 4-chloro-N-[1-(3,4-dimethoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 481.89 |
| Molecular Formula: | C24 H20 Cl N3 O6 |
| Smiles: | COc1ccc(\C=C(/C(Nc2ccc(cc2)[N+]([O-])=O)=O)NC(c2ccc(cc2)[Cl])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.3942 |
| logD: | 4.036 |
| logSw: | -4.9752 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.896 |
| InChI Key: | AYKDEJZQIPJJRX-UHFFFAOYSA-N |