AC1LXS9B
(Z)-2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethyl)anilino]prop-2-enenitrile
Also Known As: (2Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-{[2-(trifluoromethyl)phenyl]amino}prop-2-enenitrile|(Z)-2-(4-(6-bromo-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-((2-(trifluoromethyl)phenyl)amino)acrylonitrile|(Z)-2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethyl)anilino]prop-2-enenitrile
| Molecular Formula | C22H11BrF3N3O2S |
|---|---|
| Molecular Weight | 516.97076 g/mol |
| LogP | 6.67438 |
| Topological Polar Surface Area | 78.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 516.97076 |
| Monoisotopic Mass | 516.97076 |
| Heavy Atoms | 32 |
| Complexity | 1451.3163 |
Chemical Identifiers
| CAS Number | 477298-96-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)N/C=C(/C#N)\C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O |
Product Overview
AC1LXS9B (CAS 477298-96-7), with molecular formula C22H11BrF3N3O2S and molecular weight 516.97076 g/mol. IUPAC: (Z)-2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-3-[2-(trifluoromethyl)anilino]prop-2-enenitrile.
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