N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]cyclohexanecarboxamide
N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 2733-3829 |
| Compound Name: | N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]cyclohexanecarboxamide |
| Molecular Weight: | 453.49 |
| Molecular Formula: | C24 H27 N3 O6 |
| Smiles: | COc1ccc(c(c1)OC)NC(/C(=C/c1cccc(c1)[N+]([O-])=O)NC(C1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3211 |
| logD: | 4.0586 |
| logSw: | -4.419 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.304 |
| InChI Key: | JBOSVTBLCCNJRV-UHFFFAOYSA-N |