N-[3-(3-acetylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide
Chemical Structure Depiction of
N-[3-(3-acetylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide
N-[3-(3-acetylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide
Compound characteristics
| Compound ID: | 2681-3659 |
| Compound Name: | N-[3-(3-acetylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-chloro-2-methoxybenzamide |
| Molecular Weight: | 493.9 |
| Molecular Formula: | C25 H20 Cl N3 O6 |
| Smiles: | CC(c1cccc(c1)NC(/C(=C/c1cccc(c1)[N+]([O-])=O)NC(c1cc(ccc1OC)[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4881 |
| logD: | 2.6571 |
| logSw: | -4.7661 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.093 |
| InChI Key: | AJYMUCOKUJOOSM-UHFFFAOYSA-N |