2-({2-[2-benzamido-3-(thiophen-2-yl)prop-2-enoyl]hydrazinylidene}methyl)-6-bromo-4-nitrophenyl benzoate
Chemical Structure Depiction of
2-({2-[2-benzamido-3-(thiophen-2-yl)prop-2-enoyl]hydrazinylidene}methyl)-6-bromo-4-nitrophenyl benzoate
2-({2-[2-benzamido-3-(thiophen-2-yl)prop-2-enoyl]hydrazinylidene}methyl)-6-bromo-4-nitrophenyl benzoate
Compound characteristics
| Compound ID: | 8003-6834 |
| Compound Name: | 2-({2-[2-benzamido-3-(thiophen-2-yl)prop-2-enoyl]hydrazinylidene}methyl)-6-bromo-4-nitrophenyl benzoate |
| Molecular Weight: | 619.45 |
| Molecular Formula: | C28 H19 Br N4 O6 S |
| Smiles: | C(=C(/C(N/N=C/c1cc(cc(c1OC(c1ccccc1)=O)[Br])[N+]([O-])=O)=O)NC(c1ccccc1)=O)/c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 6.0739 |
| logD: | 5.2238 |
| logSw: | -6.0323 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.43 |
| InChI Key: | NXECMCABMXJXFS-UHFFFAOYSA-N |