N-(2-fluorophenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-(2-fluorophenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | F236-0315 |
| Compound Name: | N-(2-fluorophenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 345.35 |
| Molecular Formula: | C15 H12 F N5 O2 S |
| Smiles: | CSc1ncc2C(N(CC(Nc3ccccc3F)=O)C=Nc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5473 |
| logD: | 1.5472 |
| logSw: | -2.5159 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.181 |
| InChI Key: | IEGMKZGDABYGNA-UHFFFAOYSA-N |