N-(2,6-dimethylphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-(2,6-dimethylphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | F236-0321 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 355.42 |
| Molecular Formula: | C17 H17 N5 O2 S |
| Smiles: | Cc1cccc(C)c1NC(CN1C=Nc2c(cnc(n2)SC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9518 |
| logD: | 1.9518 |
| logSw: | -2.5772 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.483 |
| InChI Key: | SWNUKQWCSCCMDL-UHFFFAOYSA-N |