AC1O3D4N
(E)-3-(4-fluoro-3-nitroanilino)-2-(4-naphthalen-1-yl-1,3-thiazol-2-yl)prop-2-enenitrile
Also Known As: (2E)-3-[(4-fluoro-3-nitrophenyl)amino]-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]prop-2-enenitrile|F0837-0541|(E)-3-((4-fluoro-3-nitrophenyl)amino)-2-(4-(naphthalen-1-yl)thiazol-2-yl)acrylonitrile|(E)-3-(4-fluoro-3-nitroanilino)-2-(4-naphthalen-1-yl-1,3-thiazol-2-yl)prop-2-enenitrile|3-[(4-fluoro-3-nitro-phenyl)amino]-2-(4-naphthalen-1-yl-1,3-thiazol-2-yl)prop-2-enenitrile
| Molecular Formula | C22H13FN4O2S |
|---|---|
| Molecular Weight | 416.0743 g/mol |
| LogP | 5.98718 |
| Topological Polar Surface Area | 91.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.0743 |
| Monoisotopic Mass | 416.0743 |
| Heavy Atoms | 30 |
| Complexity | 1335.2277 |
Chemical Identifiers
| CAS Number | 477298-56-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2C3=CSC(=N3)/C(=C/NC4=CC(=C(C=C4)F)[N+](=O)[O-])/C#N |
Product Overview
AC1O3D4N (CAS 477298-56-9), with molecular formula C22H13FN4O2S and molecular weight 416.0743 g/mol. IUPAC: (E)-3-(4-fluoro-3-nitroanilino)-2-(4-naphthalen-1-yl-1,3-thiazol-2-yl)prop-2-enenitrile.
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