ChemDiv1_001868
2-amino-5-oxo-4-(2,3,4-trimethoxyphenyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile
Also Known As: ChemDiv1_001868|Oprea1_104613|Oprea1_218441|HMS592E20|BAS 00915219|AB00074631-01|2-amino-5-oxo-4-(2,3,4-trimethoxyphenyl)-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile|AK-777/36840041|SR-01000419140-1|2-amino-5-oxo-4-(2,3,4-trimethoxyphenyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile|2-amino-5-oxo-4-(2,3,4-trimethoxyphenyl)-4H-pyrano[3,2-c]chromene-3-carbonitri le|4-amino-8-oxo-6-(2,3,4-trimethoxyphenyl)-3,9-dioxatricyclo[8.4.0.0^{2,7}]tetradeca-1(10),2(7),4,11,13-pentaene-5-carbonitrile
| Molecular Formula | C22H18N2O6 |
|---|---|
| Molecular Weight | 406.1165 g/mol |
| LogP | 3.03698 |
| Topological Polar Surface Area | 116.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.1165 |
| Monoisotopic Mass | 406.1165 |
| Heavy Atoms | 30 |
| Complexity | 1285.2529 |
Chemical Identifiers
| CAS Number | 313244-39-2 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N)OC)OC |
Product Overview
ChemDiv1_001868 (CAS 313244-39-2), with molecular formula C22H18N2O6 and molecular weight 406.1165 g/mol. IUPAC: 2-amino-5-oxo-4-(2,3,4-trimethoxyphenyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile.
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