AC1LYJ72
(2Z)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methylphenyl)acetamide
Also Known As: Oprea1_724393|BAS 00329299|BIM-0027822.P001|(2Z)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methylphenyl)acetamide|(Z)-2-cyano-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-N-(p-tolyl)acetamide|2-(3,3-dimethyl(2,3,4-trihydroisoquinolylidene))-2-cyano-N-(4-methylphenyl)ace tamide|2-cyano-2-(3,3-dimethyl-3,4-dihydro-1(2H)-isoquinolinylidene)-N-(4-methylphenyl)acetamide|(2Z)-2-cyano-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-N-(4-methylphenyl)ethanamide
| Molecular Formula | C21H21N3O |
|---|---|
| Molecular Weight | 331.16846 g/mol |
| LogP | 3.7927 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 331.16846 |
| Monoisotopic Mass | 331.16846 |
| Heavy Atoms | 25 |
| Complexity | 886.10236 |
Chemical Identifiers
| CAS Number | 301352-45-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)/C(=C\2/C3=CC=CC=C3CC(N2)(C)C)/C#N |
Product Overview
AC1LYJ72 (CAS 301352-45-4), with molecular formula C21H21N3O and molecular weight 331.16846 g/mol. IUPAC: (2Z)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methylphenyl)acetamide.
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