N-(1-Isoquinolinyl)benzamide structure

N-(1-Isoquinolinyl)benzamide

N-isoquinolin-1-ylbenzamide

Also Known As: N- benzamide|Benzamide, N-1-isoquinolyl-|N-(1-Isoquinolinyl)benzamide|N-(isoquinolin-1-yl)benzamide|N-isoquinolin-1-ylbenzamide|Benzamide, N-1-isoquinolinyl-|N-(1-Isoquinolyl)benzamide|N-isoquinolin-1-yl-benzamide|N-(1-Isoquinolinyl)benzamide #|Benzoylisoquinolinium-1-ylamine anion|1-(benzoylazanidyl)isoquinolin-2-ium|J2.547.847I

CAS: 33357-47-0
Molecular Formula C16H12N2O
Molecular Weight 248.09496 g/mol
LogP 3.3
Topological Polar Surface Area 42.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 2
Exact Mass 248.09496
Monoisotopic Mass 248.09496
Heavy Atoms 19
Complexity 312.0

Chemical Identifiers

CAS Number 33357-47-0
SMILES C1=CC=C(C=C1)C(=O)NC2=NC=CC3=CC=CC=C32
InChIKey OMLUWEHKCFFWOP-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (22 patents) Pharmaceutical Intermediates (17 patents)

Product Overview

N-(1-Isoquinolinyl)benzamide (CAS 33357-47-0), with molecular formula C16H12N2O and molecular weight 248.09496 g/mol. IUPAC: N-isoquinolin-1-ylbenzamide.

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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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