butyl 4-(5-{[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}furan-2-yl)benzoate
Chemical Structure Depiction of
butyl 4-(5-{[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}furan-2-yl)benzoate
butyl 4-(5-{[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}furan-2-yl)benzoate
Compound characteristics
| Compound ID: | 0781-2419 |
| Compound Name: | butyl 4-(5-{[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}furan-2-yl)benzoate |
| Molecular Weight: | 452.42 |
| Molecular Formula: | C22 H20 N4 O7 |
| Smiles: | CCCCOC(c1ccc(cc1)c1ccc(/C=N/Nc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8417 |
| logD: | 6.8414 |
| logSw: | -5.6332 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 115.757 |
| InChI Key: | QCNQARMQFOVMOC-UHFFFAOYSA-N |