2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | L558-0505 |
| Compound Name: | 2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 429.86 |
| Molecular Formula: | C20 H20 Cl N5 O4 |
| Smiles: | CN1C(N(CC(NCC2CCCO2)=O)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.818 |
| logD: | 1.818 |
| logSw: | -3.0787 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.534 |
| InChI Key: | LIECANINCWOYQC-CQSZACIVSA-N |