AC1O2IEN
N-[(3Z)-3-(2-anilino-1-cyano-2-oxoethylidene)isoindol-1-yl]-4-methylbenzamide
Also Known As: VU0605326-1|F3225-8363|(Z)-N-(1-(1-cyano-2-oxo-2-(phenylamino)ethylidene)-1H-isoindol-3-yl)-4-methylbenzamide|N-[(1Z)-1-[cyano(phenylcarbamoyl)methylidene]-1H-isoindol-3-yl]-4-methylbenzamide|N-[(3Z)-3-(2-anilino-1-cyano-2-oxoethylidene)isoindol-1-yl]-4-methylbenzamide|N-[3-[cyano-(phenylcarbamoyl)methylidene]isoindol-1-yl]-4-methyl-benzamide|N-[(Z)-1-[cyano(N-phenylcarbamoyl)methylene]-1H-isoindol-3-yl]-p-toluamide|N-{(1Z)-1-[1-cyano-2-oxo-2-(phenylamino)ethylidene]-1H-isoindol-3-yl}-4-methylbenzamide
| Molecular Formula | C25H18N4O2 |
|---|---|
| Molecular Weight | 406.14297 g/mol |
| LogP | 4.0586 |
| Topological Polar Surface Area | 94.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.14297 |
| Monoisotopic Mass | 406.14297 |
| Heavy Atoms | 31 |
| Complexity | 1266.879 |
Chemical Identifiers
| CAS Number | 902011-73-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=N/C(=C(/C#N)\C(=O)NC3=CC=CC=C3)/C4=CC=CC=C42 |
Product Overview
AC1O2IEN (CAS 902011-73-8), with molecular formula C25H18N4O2 and molecular weight 406.14297 g/mol. IUPAC: N-[(3Z)-3-(2-anilino-1-cyano-2-oxoethylidene)isoindol-1-yl]-4-methylbenzamide.