AC1NXHDK
(E)-3-[2-(4-chlorophenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
Also Known As: (2E)-3-[2-(4-chlorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-chlorophenyl)sulfonyl]prop-2-enenitrile|(E)-3-(2-(4-chlorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-((4-chlorophenyl)sulfonyl)acrylonitrile|(E)-3-[2-(4-chlorophenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
| Molecular Formula | C23H13Cl2N3O4S |
|---|---|
| Molecular Weight | 497.0004 g/mol |
| LogP | 5.13198 |
| Topological Polar Surface Area | 101.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 497.0004 |
| Monoisotopic Mass | 497.0004 |
| Heavy Atoms | 33 |
| Complexity | 1588.5769 |
Chemical Identifiers
| CAS Number | 620106-31-2 |
|---|---|
| SMILES | C1=CC2=NC(=C(C(=O)N2C=C1)/C=C(\C#N)/S(=O)(=O)C3=CC=C(C=C3)Cl)OC4=CC=C(C=C4)Cl |
Product Overview
AC1NXHDK (CAS 620106-31-2), with molecular formula C23H13Cl2N3O4S and molecular weight 497.0004 g/mol. IUPAC: (E)-3-[2-(4-chlorophenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-chlorophenyl)sulfonylprop-2-enenitrile.
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