5-Isobutyl-5-[1-(allylmercapto)ethyl]-2-thiobarbituric acid
5-(2-methylpropyl)-5-(1-prop-2-enylsulfanylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-Isobutyl-5-[1-(allylmercapto)ethyl]-2-thiobarbituric acid|5-(2-methylpropyl)-5-(1-prop-2-enylsulfanylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione|5-(2-Methylpropyl)-5-{1-[(prop-2-en-1-yl)sulfanyl]ethyl}-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C13H20N2O2S2 |
|---|---|
| Molecular Weight | 300.09662 g/mol |
| LogP | 1.8575 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 300.09662 |
| Monoisotopic Mass | 300.09662 |
| Heavy Atoms | 19 |
| Complexity | 387.4474 |
Chemical Identifiers
| CAS Number | 66941-89-7 |
|---|---|
| SMILES | CC(C)CC1(C(=O)NC(=S)NC1=O)C(C)SCC=C |
Product Overview
5-Isobutyl-5-[1-(allylmercapto)ethyl]-2-thiobarbituric acid (CAS 66941-89-7), with molecular formula C13H20N2O2S2 and molecular weight 300.09662 g/mol. IUPAC: 5-(2-methylpropyl)-5-(1-prop-2-enylsulfanylethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
5-Isobutyl-5-[1-(allylmercapto)ethyl]-2-thiobarbituric acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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