AC1LYT1S
(E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[2-chloro-5-(trifluoromethyl)anilino]prop-2-enenitrile
Also Known As: (E)-2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-3-((2-chloro-5-(trifluoromethyl)phenyl)amino)acrylonitrile|(E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[2-chloro-5-(trifluoromethyl)anilino]prop-2-enenitrile|2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-{[2-chloro-5-(trifluoromethyl)phenyl]amino}acrylonitrile
| Molecular Formula | C20H11ClF3N3O2S |
|---|---|
| Molecular Weight | 449.02127 g/mol |
| LogP | 6.18758 |
| Topological Polar Surface Area | 67.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.02127 |
| Monoisotopic Mass | 449.02127 |
| Heavy Atoms | 30 |
| Complexity | 1184.7703 |
Chemical Identifiers
| CAS Number | 374102-01-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)/C(=C/NC4=C(C=CC(=C4)C(F)(F)F)Cl)/C#N |
Product Overview
AC1LYT1S (CAS 374102-01-9), with molecular formula C20H11ClF3N3O2S and molecular weight 449.02127 g/mol. IUPAC: (E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[2-chloro-5-(trifluoromethyl)anilino]prop-2-enenitrile.
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