5-chloro-2-methoxy-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
5-chloro-2-methoxy-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
5-chloro-2-methoxy-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2681-3662 |
| Compound Name: | 5-chloro-2-methoxy-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 496.86 |
| Molecular Formula: | C23 H17 Cl N4 O7 |
| Smiles: | COc1ccc(cc1C(NC(=C/c1cccc(c1)[N+]([O-])=O)\C(Nc1cccc(c1)[N+]([O-])=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8149 |
| logD: | 2.984 |
| logSw: | -4.9554 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 119.648 |
| InChI Key: | RPTMFGJVNHUKKQ-UHFFFAOYSA-N |