N-[2-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl]benzamide
Chemical Structure Depiction of
N-[2-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl]benzamide
N-[2-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | 2130-0124 |
| Compound Name: | N-[2-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl]benzamide |
| Molecular Weight: | 514.45 |
| Molecular Formula: | C25 H18 N6 O7 |
| Smiles: | C1Oc2cc(/C=N/NC(C(C3c4ccccc4C(NN=3)=O)NC(c3ccccc3)=O)=O)c(cc2O1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6359 |
| logD: | 2.6348 |
| logSw: | -3.6106 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 145.907 |
| InChI Key: | RXMQZQNPKNEMGZ-JOCHJYFZSA-N |