2-[(2-butyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Chemical Structure Depiction of
2-[(2-butyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
2-[(2-butyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Compound characteristics
| Compound ID: | G786-1785 |
| Compound Name: | 2-[(2-butyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C18 H22 N6 O4 S |
| Smiles: | CCCCc1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SCC(Nc1cc(C)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2395 |
| logD: | 3.2223 |
| logSw: | -3.493 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.991 |
| InChI Key: | PTSFFYIXMPVWLC-UHFFFAOYSA-N |