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Chemical structure of Voruciclib hydrochloride

GC65311

Voruciclib hydrochloride

Also known as 2-[2-chloro-4-(trifluoromethyl)phenyl]-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]chromen-4-one;hydrochloride

Voruciclib hydrochloride is an orally active and selective CDK inhibitor with Ki values of 0·626 nM-9·1 nM· Voruciclib hydrochloride potently blocks CDK9, the transcriptional regulator of MCL-1· Voruciclib hydrochloride represses expression of MCL-1 in multiple models of diffuse large B-cell lymphoma (DLBCL)

ChemicalCAS1000023-05-1MW506.3FormulaC22H20Cl2F3NO5
CAS number
1000023-05-1
Molecular weight
506.3
Formula
C22H20Cl2F3NO5
Solubility
DMSO : ≥ 250 mg/mL (493·78 mM)
InChIKey
QCWRANLELLMJSH-OJMBIDBESA-N
Catalogue number
GC65311
Brand
GLPBIO
Computed properties PubChem CID 67409218 · TPSA 90.2 Ų · H-bond donors 4 · H-bond acceptors 9
TPSA
90.2 Ų
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
3
Heavy atoms
33

SMILES CN1CC[C@H]([C@@H]1CO)C2=C(C=C(C3=C2OC(=CC3=O)C4=C(C=C(C=C4)C(F)(F)F)Cl)O)O.Cl

Computed descriptors from PubChem (CID 67409218), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Lead time
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Pricing
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Documents
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