N-(2,5-dimethoxyphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-(2,5-dimethoxyphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | F236-0332 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-[7-(methylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 387.42 |
| Molecular Formula: | C17 H17 N5 O4 S |
| Smiles: | COc1ccc(c(c1)NC(CN1C=Nc2c(cnc(n2)SC)C1=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.4505 |
| logD: | 1.4502 |
| logSw: | -2.5589 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.355 |
| InChI Key: | AXIHCHMJPYPUBS-UHFFFAOYSA-N |