3-{[2-(5-bromopyridine-3-carbonyl)hydrazinylidene]methyl}phenyl 4-nitrobenzoate
Chemical Structure Depiction of
3-{[2-(5-bromopyridine-3-carbonyl)hydrazinylidene]methyl}phenyl 4-nitrobenzoate
3-{[2-(5-bromopyridine-3-carbonyl)hydrazinylidene]methyl}phenyl 4-nitrobenzoate
Compound characteristics
| Compound ID: | 8001-5824 |
| Compound Name: | 3-{[2-(5-bromopyridine-3-carbonyl)hydrazinylidene]methyl}phenyl 4-nitrobenzoate |
| Molecular Weight: | 469.25 |
| Molecular Formula: | C20 H13 Br N4 O5 |
| Smiles: | C(\c1cccc(c1)OC(c1ccc(cc1)[N+]([O-])=O)=O)=N/NC(c1cc(cnc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9603 |
| logD: | 3.8927 |
| logSw: | -4.0646 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.921 |
| InChI Key: | UKECJPWIDYSBHY-UHFFFAOYSA-N |