N-[3-(3,5-dichloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Chemical Structure Depiction of
N-[3-(3,5-dichloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
N-[3-(3,5-dichloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | 2681-3505 |
| Compound Name: | N-[3-(3,5-dichloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide |
| Molecular Weight: | 486.31 |
| Molecular Formula: | C23 H17 Cl2 N3 O5 |
| Smiles: | COc1ccccc1C(NC(=C/c1ccc(cc1)[N+]([O-])=O)\C(Nc1cc(cc(c1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5564 |
| logD: | 4.6408 |
| logSw: | -6.0549 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.266 |
| InChI Key: | KBCDSMXHUBBWRV-UHFFFAOYSA-N |