2-[7-(4-chlorophenyl)-1-ethyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(pyridin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[7-(4-chlorophenyl)-1-ethyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(pyridin-2-yl)methyl]acetamide
2-[7-(4-chlorophenyl)-1-ethyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(pyridin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | L558-0348 |
| Compound Name: | 2-[7-(4-chlorophenyl)-1-ethyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[(pyridin-2-yl)methyl]acetamide |
| Molecular Weight: | 450.88 |
| Molecular Formula: | C22 H19 Cl N6 O3 |
| Smiles: | CCN1C(N(CC(NCc2ccccn2)=O)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0146 |
| logD: | 3.0136 |
| logSw: | -3.6509 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.382 |
| InChI Key: | XVQHLWAZUJCSKC-UHFFFAOYSA-N |