KN-62

CAT: 0013-GTR19164123-09Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19164123-09Size:100 mg

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Description

KN-62 is a specific inhibitor of Ca2+/calmodulin-dependent protein kinase II (CaMK II) with Ki of 900 nM for rat brain CaMK II; potently antagonizes ATP-stimulated Ba2+ influx into fura-2 loaded human lymphocytes with IC50 of 12.7 nM, inhibits ATP-stimulated ethidium+ uptake with IC50 of 13.1 nM; causes hypertension and tachycardia in rats, associated with the diminished rate of GABA release in cerebrospinal fluid.

CAS Number

127191-97-3

Product Name Alternative

KN 62 | KN62

Purity

>98% (HPLC)

Solubility

10 mM in DMSO

Smiles

CN (C (CC1=CC=C (C=C1) OS (=O) (=O) C2=CC=CC3=C2C=CN=C3) C (=O) N4CCN (CC4) C5=CC=CC=C5) S (=O) (=O) C6=CC=CC7=C6C=CN=C7

Molecular Formula

C38H35N5O6S2

Molecular Weight

721.9

Storage Conditions

Storage temperature: -20°C. Stability: ≥ 2 years

Notes

For research use only.

Other Product Names

5-Isoquinolinesulfonic acid, 4-[ (2S) -2-[ (5-isoquinolinylsulfonyl) methylamino]-3-oxo-3- (4-phenyl-1-piperazinyl) propyl]phenyl ester

Chemical Information

4-((2S)-2-((5-Isoquinolinylsulfonyl)methylamino)-3-oxo-3-(4-phenyl-1-piperazinyl)propyl)phenyl 5-isoquinolinesulfonate

5-isoquinolinesulfonic acid [4-[(2S)-2-[5-isoquinolinylsulfonyl(methyl)amino]-3-oxo-3-(4-phenyl-1-piperazinyl)propyl]phenyl] ester is a member of piperazines.

CAS Number	127191-97-3
PubChem CID	5312126
IUPAC Name	[4-[(2S)-2-[isoquinolin-5-ylsulfonyl(methyl)amino]-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl] isoquinoline-5-sulfonate
Molecular Formula	C38H35N5O6S2
Molecular Weight	721.8
XLogP	5.6
Topological Polar Surface Area	147
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	10
Heavy Atom Count	51
Formal Charge	0
Complexity	1370

SMILES

CN([C@@H](CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CN=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)S(=O)(=O)C6=CC=CC7=C6C=CN=C7

InChI

InChI=1S/C38H35N5O6S2/c1-41(50(45,46)36-11-5-7-29-26-39-19-17-33(29)36)35(38(44)43-23-21-42(22-24-43)31-9-3-2-4-10-31)25-28-13-15-32(16-14-28)49-51(47,48)37-12-6-8-30-27-40-20-18-34(30)37/h2-20,26-27,35H,21-25H2,1H3/t35-/m0/s1

InChIKey

RJVLFQBBRSMWHX-DHUJRADRSA-N

Chemical Structure

2D Structure

CAS: 127191-97-3

CID: 5312126

Formula: C38H35N5O6S2

MW: 721.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	721.8
XLogP3	5.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	10
Exact Mass	721.20287620
Monoisotopic Mass	721.20287620
Topological Polar Surface Area	147 Å²
Heavy Atom Count	51
Formal Charge	0
Complexity	1370
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
A8180-5.1	KN-62
FB24811-01	KN 62

KN-62

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