5-[(sec-Butylmercapto)methyl]-5-ethylbarbituric acid
5-(butan-2-ylsulfanylmethyl)-5-ethyl-1,3-diazinane-2,4,6-trione
Also Known As: AC1L2LHW|AC1Q6GEE|5-5-ethyl-2-sodiooxy-4,6 -pyrimidinedione|5-[(sec-Butylmercapto)methyl]-5-ethylbarbituric acid|5-(butan-2-ylsulfanylmethyl)-5-ethyl-1,3-diazinane-2,4,6-trione|5-[(butan-2-ylsulfanyl)methyl]-5-ethylpyrimidine-2,4,6(1h,3h,5h)-trione|5-{[(Butan-2-yl)sulfanyl]methyl}-5-ethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C11H18N2O3S |
|---|---|
| Molecular Weight | 258.10382 g/mol |
| LogP | 1.28 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.10382 |
| Heavy Atoms | 17 |
| Complexity | 323.6 |
Chemical Identifiers
| CAS Number | 67050-72-0 |
|---|---|
| SMILES | CCC(C)SCC1(C(=O)NC(=O)NC1=O)CC |
Product Overview
5-[(sec-Butylmercapto)methyl]-5-ethylbarbituric acid (CAS 67050-72-0), with molecular formula C11H18N2O3S and molecular weight 258.10382 g/mol. IUPAC: 5-(butan-2-ylsulfanylmethyl)-5-ethyl-1,3-diazinane-2,4,6-trione.
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