N-benzyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-benzyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | F236-0080 |
| Compound Name: | N-benzyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 355.42 |
| Molecular Formula: | C17 H17 N5 O2 S |
| Smiles: | CCSc1ncc2C(N(CC(NCc3ccccc3)=O)C=Nc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7434 |
| logD: | 1.7434 |
| logSw: | -2.6596 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.201 |
| InChI Key: | UAQRTZJVAKGJDK-UHFFFAOYSA-N |