AC1O3A6R structure

AC1O3A6R

4-[(1-ethylpyrrolidin-2-yl)methyliminomethyl]-3-hydroxy-2-(3-methoxyphenyl)isoquinolin-1-one

Also Known As: 4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylidene]-2-(3-methoxyphenyl)isoquinoline-1,3-dione|(4E)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)-2-(3-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione|(4E)-4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylidene]-2-(3-methoxyphenyl)isoquinoline-1,3-dione|(E)-4-((((1-ethylpyrrolidin-2-yl)methyl)amino)methylene)-2-(3-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione

CAS: 896077-84-2
Molecular Formula C24H27N3O3
Molecular Weight 405.20523 g/mol
LogP 3.6081
Topological Polar Surface Area 67.06 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 405.20523
Monoisotopic Mass 405.20523
Heavy Atoms 30
Complexity 1136.2346

Chemical Identifiers

CAS Number 896077-84-2
SMILES CCN1CCCC1CN=CC2=C(N(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)OC)O

Product Overview

AC1O3A6R (CAS 896077-84-2), with molecular formula C24H27N3O3 and molecular weight 405.20523 g/mol. IUPAC: 4-[(1-ethylpyrrolidin-2-yl)methyliminomethyl]-3-hydroxy-2-(3-methoxyphenyl)isoquinolin-1-one.

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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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