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BRD6989

CAT: 0931-T14778-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T14778-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
642008-81-9
Target
Interleukin, IL Receptor, CDK
Related Pathways
Cell Cycle/Checkpoint, Immunology/Inflammation
Purity
0.9943
Bioactivity
BRD6989 is an analog of the natural product cortistatin A (dCA) . Which inhibits CDK8 and upregulates IL-10. BRD6989 inhibits the kinase activity of recombinant CDK8 or CDK19 complexes. BRD6989 selectively binds a complex of CDK8 with an IC50 of ~200 nM.
Smiles
CC1CCc2nc(N)c(C#N)c(-c3cccnc3)c2C1
Molecular Formula
C16H16N4
Molecular Weight
264.33
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

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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A22332-5BRD6989 5mg
A22332-1BRD6989 1mg
A22332-100BRD6989 100mg
A22332-25BRD6989 25mg
A22332-50BRD6989 50mg
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