2-chloro-N-[1-(4-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
2-chloro-N-[1-(4-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
2-chloro-N-[1-(4-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 3379-2883 |
| Compound Name: | 2-chloro-N-[1-(4-methoxyphenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 451.87 |
| Molecular Formula: | C23 H18 Cl N3 O5 |
| Smiles: | COc1ccc(\C=C(/C(Nc2ccc(cc2)[N+]([O-])=O)=O)NC(c2ccccc2[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6384 |
| logD: | 4.0845 |
| logSw: | -4.8805 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.179 |
| InChI Key: | YLQCJEZLMDOKJC-UHFFFAOYSA-N |