AC1N5OJ1 structure

AC1N5OJ1

2-(3-butoxyphenyl)-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]quinoline-4-carboxamide

Also Known As: AK-968/41170085|2-(3-butoxyphenyl)-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]quinoline-4-carboxamide|2-(3-butoxyphenyl)-N-{4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl}quinoline-4-carboxamide|[2-(3-butoxyphenyl)(4-quinolyl)]-N-(4-{[(6-methoxypyrimidin-4-yl)amino]sulfony l}phenyl)carboxamide|2-(3-butoxyphenyl)-N-(4-{[(6-methoxy-4-pyrimidinyl)amino]sulfonyl}phenyl)-4-quinolinecarboxamide

CAS: 445259-57-4
Molecular Formula C31H29N5O5S
Molecular Weight 583.18896 g/mol
LogP 5.9324
Topological Polar Surface Area 132.4 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 11
Exact Mass 583.18896
Monoisotopic Mass 583.18896
Heavy Atoms 42
Complexity 1828.1533

Chemical Identifiers

CAS Number 445259-57-4
SMILES CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=CC(=NC=N5)OC

Product Overview

AC1N5OJ1 (CAS 445259-57-4), with molecular formula C31H29N5O5S and molecular weight 583.18896 g/mol. IUPAC: 2-(3-butoxyphenyl)-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]quinoline-4-carboxamide.

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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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