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1-[(3S)-1-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-3-yl]-3-[4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)phenyl]urea , CAS No.S608909, Inhibitor of cyclin dependent kinase 8

  • Moligand™
Item Number
S608909
Grouped product items
SKUSizeAvailabilityPrice Qty
S608909-5mg
5mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$700.90
S608909-25mg
25mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$2,000.90
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cyclin dependent kinase 8 Inhibitor

Basic Description

Synonymscompound 20
Specifications & PurityMoligand™
GradeMoligand™
Action TypeINHIBITOR
Mechanism of actionInhibitor of cyclin dependent kinase 8

Associated Targets

CDK8 Tchem Cyclin-dependent kinase 8 1 Activities

Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)

FLT3 Tclin Receptor-type tyrosine-protein kinase FLT3 0 Activities

Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)

Names and Identifiers

IUPAC Name 1-[(3S)-1-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-3-yl]-3-[4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)phenyl]urea
INCHI InChI=1S/C22H28F3N7O2/c1-26-20-27-6-4-19(30-20)32-7-5-17(14-32)29-21(33)28-16-3-2-15(18(12-16)22(23,24)25)13-31-8-10-34-11-9-31/h2-4,6,12,17H,5,7-11,13-14H2,1H3,(H,26,27,30)(H2,28,29,33)/t17-/m0/s1
InChi Key LVIYMOOJJGCMCP-KRWDZBQOSA-N
Canonical SMILES CNc1nccc(n1)N1CC[C@@H](C1)NC(=O)Nc1ccc(c(c1)C(F)(F)F)CN1CCOCC1
Isomeric SMILES CNC1=NC=CC(=N1)N2CC[C@@H](C2)NC(=O)NC3=CC(=C(C=C3)CN4CCOCC4)C(F)(F)F
PubChem CID 117995570

Certificates

Certificate of Analysis(COA)

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Related Documents

 SDS

 Specification Sheet

References

1. Bergeron P, Koehler MF, Blackwood EM, Bowman K, Clark K, Firestein R, Kiefer JR, Maskos K, McCleland ML, Orren L et al..  (2016)  Design and Development of a Series of Potent and Selective Type II Inhibitors of CDK8..  ACS Med Chem Lett,  7  (6): (595-600).  [PMID:27326333]
2. Dale T, Clarke PA, Esdar C, Waalboer D, Adeniji-Popoola O, Ortiz-Ruiz MJ, Mallinger A, Samant RS, Czodrowski P, Musil D et al..  (2015)  A selective chemical probe for exploring the role of CDK8 and CDK19 in human disease..  Nat Chem Biol,  11  (12): (973-80).  [PMID:26502155]

Solution Calculators

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