AC1LITU3
(5E)-5-[(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: (5E)-5-[(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione|(5E)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione|(E)-5-((1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|5-[1-(1-Cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)-meth-(E)-ylidene]-1-methyl-2-thioxo-dihydro-pyrimidine-4,6-dione
| Molecular Formula | C18H23N3O2S |
|---|---|
| Molecular Weight | 345.1511 g/mol |
| LogP | 2.86664 |
| Topological Polar Surface Area | 54.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 345.1511 |
| Monoisotopic Mass | 345.1511 |
| Heavy Atoms | 24 |
| Complexity | 741.6902 |
Chemical Identifiers
| CAS Number | 1164544-48-2 |
|---|---|
| SMILES | CC1=CC(=C(N1C2CCCCC2)C)/C=C/3\C(=O)NC(=S)N(C3=O)C |
Product Overview
AC1LITU3 (CAS 1164544-48-2), with molecular formula C18H23N3O2S and molecular weight 345.1511 g/mol. IUPAC: (5E)-5-[(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
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