3,4-dimethoxy-N-[1-(2-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-[1-(2-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
3,4-dimethoxy-N-[1-(2-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2535-3085 |
| Compound Name: | 3,4-dimethoxy-N-[1-(2-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 477.47 |
| Molecular Formula: | C25 H23 N3 O7 |
| Smiles: | COc1ccccc1/C=C(/C(Nc1ccc(cc1)[N+]([O-])=O)=O)NC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0083 |
| logD: | 3.8217 |
| logSw: | -4.3426 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.527 |
| InChI Key: | WTQSVPHQSAKCIA-UHFFFAOYSA-N |