4-Pyrimidinecarboxylic acid, 5-((4-methoxyphenyl)thio)-2-(methylthio)-
5-(4-methoxyphenyl)sulfanyl-2-methylsulfanylpyrimidine-4-carboxylic acid
Also Known As: 5-25-07-00008 (Beilstein Handbook Reference)|4-Pyrimidinecarboxylic acid, 5-((4-methoxyphenyl)thio)-2-(methylthio)-|5-((4-Methoxyphenyl)thio)-2-(methylthio)-4-pyrimidinecarboxylic acid|5-[(4-methoxyphenyl)sulfanyl]-2-(methylsulfanyl)pyrimidine-4-carboxylic acid|5-((4-Methoxyphenyl)thio)-2-(methylthio)pyrimidine-4-carboxylic acid|5-(4-methoxyphenyl)sulfanyl-2-methylsulfanylpyrimidine-4-carboxylic acid|4-Pyrimidinecarboxylic acid,5-((4-methoxyphenyl)thio)-2-(methylthio)|4-Pyrimidinecarboxylicacid, 5-[(4-methoxyphenyl)thio]-2-(methylthio)-
| Molecular Formula | C13H12N2O3S2 |
|---|---|
| Molecular Weight | 308.02893 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.02893 |
| Monoisotopic Mass | 308.02893 |
| Heavy Atoms | 20 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 5563-39-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)SC2=CN=C(N=C2C(=O)O)SC |
| InChIKey | ZGTVERZVINWYAT-UHFFFAOYSA-N |
Product Overview
4-Pyrimidinecarboxylic acid, 5-((4-methoxyphenyl)thio)-2-(methylthio)- (CAS 5563-39-3), with molecular formula C13H12N2O3S2 and molecular weight 308.02893 g/mol. IUPAC: 5-(4-methoxyphenyl)sulfanyl-2-methylsulfanylpyrimidine-4-carboxylic acid.
4-Pyrimidinecarboxylic acid, 5-((4-methoxyphenyl)thio)-2-(methylthio)- is a custom synthesis product. We offer services from milligram to kilogram scale.
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