Oprea1_601278
2-[(3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)-phenylmethylidene]propanedinitrile
Also Known As: Oprea1_601278|{phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile|2-((3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)(phenyl)methylene)malononitrile|2-[(3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)-phenylmethylidene]propanedinitrile
| Molecular Formula | C35H25N3O |
|---|---|
| Molecular Weight | 503.19977 g/mol |
| LogP | 7.18006 |
| Topological Polar Surface Area | 67.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 503.19977 |
| Monoisotopic Mass | 503.19977 |
| Heavy Atoms | 39 |
| Complexity | 1643.9922 |
Chemical Identifiers
| CAS Number | 384348-75-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(C3C4=CC=CC=C4C=CN3C2C(=O)C5=CC=CC=C5)C(=C(C#N)C#N)C6=CC=CC=C6 |
Product Overview
Oprea1_601278 (CAS 384348-75-8), with molecular formula C35H25N3O and molecular weight 503.19977 g/mol. IUPAC: 2-[(3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)-phenylmethylidene]propanedinitrile.
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