4-methoxy-3-nitro-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-methoxy-3-nitro-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
4-methoxy-3-nitro-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2733-3863 |
| Compound Name: | 4-methoxy-3-nitro-N-[3-(3-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 507.42 |
| Molecular Formula: | C23 H17 N5 O9 |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(NC(=C/c1cccc(c1)[N+]([O-])=O)\C(Nc1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.65 |
| logD: | 3.0476 |
| logSw: | -4.0722 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 152.728 |
| InChI Key: | PBUDLSTWCCVLLC-UHFFFAOYSA-N |