3-(4-ethoxyphenyl)-N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
3-(4-ethoxyphenyl)-N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | K979-0795 |
| Compound Name: | 3-(4-ethoxyphenyl)-N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 460.45 |
| Molecular Formula: | C24 H20 N4 O6 |
| Smiles: | CCOc1ccc(cc1)N1C(c2ccccc2C(C(Nc2cc(ccc2OC)[N+]([O-])=O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8868 |
| logD: | 3.1422 |
| logSw: | -3.9405 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.577 |
| InChI Key: | XCMVLJZHSRWVDI-UHFFFAOYSA-N |