2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]-N-[(4-methylphenyl)methyl]butanamide
2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | F236-1009 |
| Compound Name: | 2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 397.5 |
| Molecular Formula: | C20 H23 N5 O2 S |
| Smiles: | CCC(C(NCc1ccc(C)cc1)=O)N1C=Nc2c(cnc(n2)SCC)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7607 |
| logD: | 2.7607 |
| logSw: | -3.138 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.506 |
| InChI Key: | NLQAWDRZQYBEPW-INIZCTEOSA-N |