AC1NXQGA
1-(2,5-dimethoxyphenyl)-5-[[4-[ethyl(2-hydroxyethyl)amino]phenyl]iminomethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one
Also Known As: (5E)-1-(2,5-dimethoxyphenyl)-5-[({4-[ethyl(2-hydroxyethyl)amino]phenyl}amino)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione|(5E)-1-(2,5-dimethoxyphenyl)-5-[[4-[ethyl(2-hydroxyethyl)amino]anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|(E)-1-(2,5-dimethoxyphenyl)-5-(((4-(ethyl(2-hydroxyethyl)amino)phenyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|1-(2,5-dimethoxyphenyl)-5-[[4-[ethyl(2-hydroxyethyl)amino]anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C23H26N4O5S |
|---|---|
| Molecular Weight | 470.16238 g/mol |
| LogP | 3.18709 |
| Topological Polar Surface Area | 112.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.16238 |
| Monoisotopic Mass | 470.16238 |
| Heavy Atoms | 33 |
| Complexity | 1251.1871 |
Chemical Identifiers
| CAS Number | 674366-06-4 |
|---|---|
| SMILES | CCN(CCO)C1=CC=C(C=C1)N=CC2=C(N(C(=S)NC2=O)C3=C(C=CC(=C3)OC)OC)O |
Product Overview
AC1NXQGA (CAS 674366-06-4), with molecular formula C23H26N4O5S and molecular weight 470.16238 g/mol. IUPAC: 1-(2,5-dimethoxyphenyl)-5-[[4-[ethyl(2-hydroxyethyl)amino]phenyl]iminomethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one.