2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(pyridin-3-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-[(pyridin-3-yl)methyl]acetamide
2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(pyridin-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | L558-0515 |
| Compound Name: | 2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(pyridin-3-yl)methyl]acetamide |
| Molecular Weight: | 436.86 |
| Molecular Formula: | C21 H17 Cl N6 O3 |
| Smiles: | CN1C(N(CC(NCc2cccnc2)=O)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1348 |
| logD: | 2.1324 |
| logSw: | -3.3307 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.398 |
| InChI Key: | ZVHBAFDANHKAGH-UHFFFAOYSA-N |