AC1NKIJS structure

AC1NKIJS

2-[4-[[1-(1-adamantyl)-5-chloro-6-oxopyridazin-4-yl]amino]phenyl]acetic acid

Also Known As: SR-01000134291-1|2-[4-[[1-(1-adamantyl)-5-chloro-6-oxo-pyridazin-4-yl]amino]phenyl]acetic Acid|2-[4-[[1-(1-adamantyl)-5-chloro-6-oxopyridazin-4-yl]amino]phenyl]acetic acid|(4-{[5-chloro-6-oxo-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,6-dihydropyridazin-4-yl]amino}phenyl)acetic acid|2-(4-((1-((3s,5s,7s)-adamantan-1-yl)-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)amino)phenyl)acetic acid|2-(4-{[1-(ADAMANTAN-1-YL)-5-CHLORO-6-OXO-1,6-DIHYDROPYRIDAZIN-4-YL]AMINO}PHENYL)ACETIC ACID

CAS: 896833-66-2
Molecular Formula C22H24ClN3O3
Molecular Weight 413.1506 g/mol
LogP 4.1927
Topological Polar Surface Area 84.22 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 413.1506
Monoisotopic Mass 413.1506
Heavy Atoms 29
Complexity 979.66864

Chemical Identifiers

CAS Number 896833-66-2
SMILES C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=C(C=N4)NC5=CC=C(C=C5)CC(=O)O)Cl

Product Overview

AC1NKIJS (CAS 896833-66-2), with molecular formula C22H24ClN3O3 and molecular weight 413.1506 g/mol. IUPAC: 2-[4-[[1-(1-adamantyl)-5-chloro-6-oxopyridazin-4-yl]amino]phenyl]acetic acid.

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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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