2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F521-0228 |
| Compound Name: | 2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C25 H22 N4 O5 |
| Smiles: | Cc1ccc(CNC(CN2C(N(Cc3ccc4c(c3)OCO4)C(c3c2cccn3)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.874 |
| logD: | 2.874 |
| logSw: | -3.2454 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.763 |
| InChI Key: | SNLXRZFDJCWACP-UHFFFAOYSA-N |