AC1N6CDS
2-amino-4-[2-[(4-chlorophenyl)methoxy]phenyl]-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile
Also Known As: Oprea1_727226|AM-807/12426161|2-amino-4-{2-[(4-chlorobenzyl)oxy]phenyl}-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile|2-amino-4-(2-((4-chlorobenzyl)oxy)phenyl)-7-methyl-5-oxo-4,5-dihydropyrano[4,3-b]pyran-3-carbonitrile|2-amino-4-[2-[(4-chlorophenyl)methoxy]phenyl]-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile|2-amino-4-{2-[(4-chlorophenyl)methoxy]phenyl}-7-methyl-5-oxo-4H-pyrano[3,2-c]p yran-3-carbonitrile
| Molecular Formula | C23H17ClN2O4 |
|---|---|
| Molecular Weight | 420.08768 g/mol |
| LogP | 4.3988 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.08768 |
| Monoisotopic Mass | 420.08768 |
| Heavy Atoms | 30 |
| Complexity | 1239.2933 |
Chemical Identifiers
| CAS Number | 354553-02-9 |
|---|---|
| SMILES | CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3OCC4=CC=C(C=C4)Cl)C(=O)O1 |
Product Overview
AC1N6CDS (CAS 354553-02-9), with molecular formula C23H17ClN2O4 and molecular weight 420.08768 g/mol. IUPAC: 2-amino-4-[2-[(4-chlorophenyl)methoxy]phenyl]-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile.
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