ethyl 3-{2-[7-(morpholin-4-yl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[7-(morpholin-4-yl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate
ethyl 3-{2-[7-(morpholin-4-yl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L391-0887 |
| Compound Name: | ethyl 3-{2-[7-(morpholin-4-yl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 438.44 |
| Molecular Formula: | C21 H22 N6 O5 |
| Smiles: | CCOC(c1cccc(c1)NC(CN1C=Nc2c(cnc(n2)N2CCOCC2)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5747 |
| logD: | 1.5747 |
| logSw: | -2.4079 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.199 |
| InChI Key: | BIFAEPDDDQHWAL-UHFFFAOYSA-N |