N-(2-ethyl-6-methylphenyl)-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-(2-ethyl-6-methylphenyl)-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | F236-0054 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C19 H21 N5 O2 S |
| Smiles: | CCc1cccc(C)c1NC(CN1C=Nc2c(cnc(n2)SCC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8344 |
| logD: | 2.8343 |
| logSw: | -2.9637 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.483 |
| InChI Key: | YLJRUMGBFQYZGZ-UHFFFAOYSA-N |