N-(3,4-dimethoxyphenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
N-(3,4-dimethoxyphenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | C696-0707 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C24 H22 N4 O4 |
| Smiles: | COc1ccc(cc1OC)NC(CN1C(c2ccccc2C(Cc2ccncc2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.976 |
| logD: | 1.9719 |
| logSw: | -2.8395 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.937 |
| InChI Key: | KOMMHMLFMOIHIC-UHFFFAOYSA-N |