N-[3-(2-bromo-5-chloroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide
Chemical Structure Depiction of
N-[3-(2-bromo-5-chloroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide
N-[3-(2-bromo-5-chloroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide
Compound characteristics
| Compound ID: | 2681-3598 |
| Compound Name: | N-[3-(2-bromo-5-chloroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide |
| Molecular Weight: | 565.21 |
| Molecular Formula: | C23 H16 Br Cl2 N3 O5 |
| Smiles: | COc1ccc(cc1C(NC(=C/c1cccc(c1)[N+]([O-])=O)\C(Nc1cc(ccc1[Br])[Cl])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9857 |
| logD: | 3.221 |
| logSw: | -6.15 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.568 |
| InChI Key: | CAJCVYGUCQQRSE-UHFFFAOYSA-N |