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Chemical structure of R 59-022 hydrochloride

GC69792

R 59-022 hydrochloride

Also known as 6-[2-[4-[(4-fluorophenyl)-phenylmethylidene]piperidin-1-yl]ethyl]-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one;hydrochloride

R 59-022 (DKGI-I) hydrochloride is a DGK inhibitor (IC50: 2·8 μM)· R 59-022 hydrochloride inhibits OAG phosphorylation to OAPA· It is also a 5-HT receptor antagonist that can activate protein kinase C (PKC)· R 59-022 enhances the production of thromboxane in platelets induced by thrombin and inhibits phosphatidic acid production in neutrophils

ChemicalCAS93076-98-3MW496.04FormulaC27H27ClFN3OS
CAS number
93076-98-3
Molecular weight
496.04
Formula
C27H27ClFN3OS
Solubility
DMSO : 25 mg/mL (50·40 mM; Need ultrasonic)
InChIKey
APNKGVNEUKASGR-UHFFFAOYSA-N
Catalogue number
GC69792
Brand
GLPBIO
Computed properties PubChem CID 23326062 · TPSA 61.2 Ų · H-bond donors 1 · H-bond acceptors 5
TPSA
61.2 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
34

SMILES CC1=C(C(=O)N2C=CSC2=N1)CCN3CCC(=C(C4=CC=CC=C4)C5=CC=C(C=C5)F)CC3.Cl

Computed descriptors from PubChem (CID 23326062), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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