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SOICR-IN-1

CAT: 0804-HY-103059-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-103059-01Size:5 mg
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Description
SOICR-IN-1 (compound 32) is a store-overload induced calcium release (SOICR) inhibitor with an IC50 value of 14.6 μM. SOICR-IN-1 can be used for the research of cardiac arrhythmias[1].
CAS Number
1479049-35-8
UNSPSC
12352005
Target
Calcium Channel
Type
Reference compound
Related Pathways
Membrane Transporter/Ion Channel; Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/soicr-in-1.html
Purity
99.62
Solubility
DMSO : 66.67 mg/mL (ultrasonic)
Smiles
O=C1N(CCOC2=CC=CC=C2OC)CC(CCOC3=CC=CC(N4)=C3C5=C4C=CC=C5)OC1
Molecular Formula
C27H28N2O5
Molecular Weight
460.52
References & Citations
[1]Smith CD, et al. Novel carvedilol analogues that suppress store-overload-induced Ca2+ release. J Med Chem. 2013 Nov 14;56 (21) :8626-55.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Homo-VK-II-36
CAS Number1479049-35-8
PubChem CID72711387
IUPAC Name6-[2-(9H-carbazol-4-yloxy)ethyl]-4-[2-(2-methoxyphenoxy)ethyl]morpholin-3-one
Molecular FormulaC27H28N2O5
Molecular Weight460.5
XLogP4.8
Topological Polar Surface Area73
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count34
Formal Charge0
Complexity663
SMILES
COC1=CC=CC=C1OCCN2CC(OCC2=O)CCOC3=CC=CC4=C3C5=CC=CC=C5N4
InChI
InChI=1S/C27H28N2O5/c1-31-23-10-4-5-11-24(23)33-16-14-29-17-19(34-18-26(29)30)13-15-32-25-12-6-9-22-27(25)20-7-2-3-8-21(20)28-22/h2-12,19,28H,13-18H2,1H3
InChIKey
VANQAPUAZCJPGY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Homo-VK-II-36
CAS: 1479049-35-8
CID: 72711387
Formula: C27H28N2O5
MW: 460.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight460.5
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass460.19982200
Monoisotopic Mass460.19982200
Topological Polar Surface Area73 Ų
Heavy Atom Count34
Formal Charge0
Complexity663
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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