2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Compound characteristics
Compound ID: | 5493-0037 |
Compound Name: | 2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide |
Molecular Weight: | 376.45 |
Molecular Formula: | C16 H16 N4 O3 S2 |
Smiles: | CCC1C(NC(=NC1=O)SCC(Nc1nc2ccc(C)cc2s1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.3408 |
logD: | -2.843 |
logSw: | -2.8661 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.205 |
InChI Key: | VWVXQCGNPLNMGL-UHFFFAOYSA-N |