methyl 4-(2-{3-[(4-methylphenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{3-[(4-methylphenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate
methyl 4-(2-{3-[(4-methylphenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | F521-0307 |
| Compound Name: | methyl 4-(2-{3-[(4-methylphenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamido)benzoate |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C25 H22 N4 O5 |
| Smiles: | Cc1ccc(CN2C(c3c(cccn3)N(CC(Nc3ccc(cc3)C(=O)OC)=O)C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5158 |
| logD: | 3.5157 |
| logSw: | -3.5573 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.499 |
| InChI Key: | SWQVQCYOPIGKEZ-UHFFFAOYSA-N |