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BRD6989

CAT: 0804-HY-122586-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-122586-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BRD6989, an analog of the natural product cortistatin A (dCA), inhibits CDK8 and upregulates IL-10. BRD6989 selectively binds a complex of CDK8 with an IC50 of ~200 nM. BRD6989 inhibits the kinase activity of recombinant CDK8 or CDK19 complexes[1].
CAS Number
642008-81-9
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
CDK; Interleukin Related
Type
Reference compound
Related Pathways
Cell Cycle/DNA Damage; Immunology/Inflammation
Applications
COVID-19-anti-virus
Field of Research
Inflammation/Immunology
Assay Protocol
https://www.medchemexpress.com/brd6989.html
Purity
99.56
Solubility
DMSO : 25 mg/mL (ultrasonic)
Smiles
N#CC1=C(C2=CC=CN=C2)C3=C(N=C1N)CCC(C)C3
Molecular Formula
C16H16N4
Molecular Weight
264.33
Precautions
H302, H315, H319, H335
References & Citations
[1]Johannessen L, et al. Small-molecule studies identify CDK8 as a regulator of IL-10 in myeloid cells. Nat Chem Biol. 2017 Oct;13 (10) :1102-1108
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
CDK19; CDK8; IL-10

Chemical Information

2-Amino-6-methyl-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

2-amino-6-methyl-4-(3-pyridinyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile is a member of bipyridines.

CAS Number642008-81-9
PubChem CID3835861
IUPAC Name2-amino-6-methyl-4-pyridin-3-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Molecular FormulaC16H16N4
Molecular Weight264.32
XLogP2.8
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity387
SMILES
CC1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=CN=CC=C3
InChI
InChI=1S/C16H16N4/c1-10-4-5-14-12(7-10)15(11-3-2-6-19-9-11)13(8-17)16(18)20-14/h2-3,6,9-10H,4-5,7H2,1H3,(H2,18,20)
InChIKey
QSYBDNXNOJIKML-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Amino-6-methyl-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS: 642008-81-9
CID: 3835861
Formula: C16H16N4
MW: 264.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight264.32
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass264.137496527
Monoisotopic Mass264.137496527
Topological Polar Surface Area75.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity387
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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