N-[2-(2,5-dimethoxyphenyl)ethyl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-[2-(2,5-dimethoxyphenyl)ethyl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
N-[2-(2,5-dimethoxyphenyl)ethyl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | C696-0983 |
| Compound Name: | N-[2-(2,5-dimethoxyphenyl)ethyl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C26 H26 N4 O4 |
| Smiles: | COc1ccc(c(CCNC(CN2C(c3ccccc3C(Cc3ccncc3)=N2)=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.143 |
| logD: | 2.139 |
| logSw: | -2.9171 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.014 |
| InChI Key: | BILBMFXBJXCUEL-UHFFFAOYSA-N |