N-{[2-methoxy-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)phenyl]methyl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{[2-methoxy-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)phenyl]methyl}-4-nitrobenzamide
N-{[2-methoxy-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)phenyl]methyl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 6216-0092 |
| Compound Name: | N-{[2-methoxy-5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)phenyl]methyl}-4-nitrobenzamide |
| Molecular Weight: | 444.45 |
| Molecular Formula: | C24 H20 N4 O5 |
| Smiles: | CN1C(c2ccccc2C(c2ccc(c(CNC(c3ccc(cc3)[N+]([O-])=O)=O)c2)OC)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3543 |
| logD: | 3.3538 |
| logSw: | -3.7714 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.571 |
| InChI Key: | VKQFSUWJDOQQET-UHFFFAOYSA-N |