N-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | K979-1030 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C24 H19 N3 O6 |
| Smiles: | COc1ccc(c(c1)OC)N1C(c2ccccc2C(C(Nc2ccc3c(c2)OCO3)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6171 |
| logD: | 3.6138 |
| logSw: | -3.9485 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.128 |
| InChI Key: | PJBVSBXORNNIBI-UHFFFAOYSA-N |