Oprea1_601278 structure

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

CAS: 384348-75-8
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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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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