ethyl 2-{2-[4-oxo-7-(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[4-oxo-7-(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate
ethyl 2-{2-[4-oxo-7-(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L391-0453 |
| Compound Name: | ethyl 2-{2-[4-oxo-7-(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 436.47 |
| Molecular Formula: | C22 H24 N6 O4 |
| Smiles: | CCOC(c1ccccc1NC(CN1C=Nc2c(cnc(n2)N2CCCCC2)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2196 |
| logD: | 2.2096 |
| logSw: | -2.8493 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.592 |
| InChI Key: | HZMJMSKXJBWUMX-UHFFFAOYSA-N |