AC1LX25L
2-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide
Also Known As: AK-968/41024230|2-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide|(2-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)(4-quinolyl))-N-[3-cyano-4-(4-ethylphenyl )-5-methyl(2-thienyl)]carboxamide|2-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-ethylphenyl)-5-methyl-2-thienyl]-4-quinolinecarboxamide
| Molecular Formula | C31H23N3O3S |
|---|---|
| Molecular Weight | 517.146 g/mol |
| LogP | 7.3538 |
| Topological Polar Surface Area | 84.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 517.146 |
| Monoisotopic Mass | 517.146 |
| Heavy Atoms | 38 |
| Complexity | 1749.5724 |
Chemical Identifiers
| CAS Number | 445233-48-7 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6)C |
Product Overview
AC1LX25L (CAS 445233-48-7), with molecular formula C31H23N3O3S and molecular weight 517.146 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide.
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