4-bromo-N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
4-bromo-N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 3379-3083 |
| Compound Name: | 4-bromo-N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 470.28 |
| Molecular Formula: | C21 H16 Br N3 O5 |
| Smiles: | C(c1ccco1)NC(/C(=C/c1cccc(c1)[N+]([O-])=O)NC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.341 |
| logD: | 2.5311 |
| logSw: | -4.5042 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.707 |
| InChI Key: | ZYUKCZSPAFCYPT-UHFFFAOYSA-N |