N-butyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-butyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-butyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | F236-0086 |
| Compound Name: | N-butyl-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 321.4 |
| Molecular Formula: | C14 H19 N5 O2 S |
| Smiles: | CCCCNC(CN1C=Nc2c(cnc(n2)SCC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3971 |
| logD: | 1.3971 |
| logSw: | -2.4044 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.314 |
| InChI Key: | LFPVUBYUKZJXSO-UHFFFAOYSA-N |