[1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetic acid
Chemical Structure Depiction of
[1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetic acid
[1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetic acid
Compound characteristics
| Compound ID: | C066-5739 |
| Compound Name: | [1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetic acid |
| Molecular Weight: | 326.31 |
| Molecular Formula: | C16 H14 N4 O4 |
| Smiles: | Cc1ccc(cc1)c1ncc2C(N(CC(O)=O)C(N(C)c2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0445 |
| logD: | -2.9833 |
| logSw: | -2.0611 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.064 |
| InChI Key: | VGLBONIVCOSNKD-UHFFFAOYSA-N |