2-[7-(4-chlorophenyl)-1-ethyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}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-{3-[(propan-2-yl)oxy]propyl}acetamide
2-[7-(4-chlorophenyl)-1-ethyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}acetamide
Compound characteristics
| Compound ID: | L558-0382 |
| Compound Name: | 2-[7-(4-chlorophenyl)-1-ethyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}acetamide |
| Molecular Weight: | 459.93 |
| Molecular Formula: | C22 H26 Cl N5 O4 |
| Smiles: | CCN1C(N(CC(NCCCOC(C)C)=O)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9319 |
| logD: | 2.9319 |
| logSw: | -3.5624 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.153 |
| InChI Key: | JHEPMHKZEJRTQC-UHFFFAOYSA-N |