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MSC2530818

CAT: 0013-GTR19164484-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19164484-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
MSC2530818 is a potent and selective CDK8 inhibitor with an IC50 of 2.6 nM, demonstrating oral bioavailability. It is a valuable research tool for studying the Mediator complex in oncology and inflammation, with utility in both cellular assays and in vivo models.
CAS Number
1883423-59-3
Product Name Alternative
Inhibit, MSC 2530818, MSC2530818, MSC-2530818, Inhibitor, Cyclin dependent kinase, CDK, CDK8
Field of Research
Cell Biology
Purity
98.93% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:4 mg/mL (11.74 mM) ; DMSO:120 mg/mL (352.1 mM)
Smiles
Cc1n[nH]c2ncc (cc12) C (=O) N1CCC[C@H]1c1ccc (Cl) cc1
Molecular Formula
C18H17ClN4O
Molecular Weight
340.81
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

[(2S)-2-(4-chlorophenyl)pyrrolidin-1-yl]-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CAS Number1883423-59-3
PubChem CID118879529
IUPAC Name[(2S)-2-(4-chlorophenyl)pyrrolidin-1-yl]-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
Molecular FormulaC18H17ClN4O
Molecular Weight340.8
XLogP3.3
Topological Polar Surface Area61.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity468
SMILES
CC1=C2C=C(C=NC2=NN1)C(=O)N3CCC[C@H]3C4=CC=C(C=C4)Cl
InChI
InChI=1S/C18H17ClN4O/c1-11-15-9-13(10-20-17(15)22-21-11)18(24)23-8-2-3-16(23)12-4-6-14(19)7-5-12/h4-7,9-10,16H,2-3,8H2,1H3,(H,20,21,22)/t16-/m0/s1
InChIKey
ODRITQGYYWHQGM-INIZCTEOSA-N
Chemical Structure
2D Structure
2D structure of [(2S)-2-(4-chlorophenyl)pyrrolidin-1-yl]-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CAS: 1883423-59-3
CID: 118879529
Formula: C18H17ClN4O
MW: 340.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight340.8
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass340.1090889
Monoisotopic Mass340.1090889
Topological Polar Surface Area61.9 Ų
Heavy Atom Count24
Formal Charge0
Complexity468
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA3770-50MSC2530818
A12644-50MSC2530818 50mg
A12644-25MSC2530818 25mg
A12644-10MSC2530818 10mg
A12644-1MSC2530818 1mg

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