ChemicalBook--->CAS DataBase List--->1616413-96-7

1616413-96-7

1616413-96-7 Structure

1616413-96-7 Structure
IdentificationBack Directory
[Name]

UCB9608
[CAS]

1616413-96-7
[Synonyms]

UCB9608
CS-2884
UCB 9608;UCB9608
6-amino-4-{4-[(4-methoxy-2-methylphenyl)carbamyl]-2-(S)-methylpiperazin-1-yl}-1-methylpyrazolo[3,4-d]pyrimidine
(3S)-4-(6-Amino-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-N-(4-methoxy-2-methylphenyl)-3-methyl-1-piperazinecarboxamide
1-Piperazinecarboxamide, 4-(6-amino-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-N-(4-methoxy-2-methylphenyl)-3-methyl-, (3S)-
[Molecular Formula]

C20H26N8O2
[MDL Number]

MFCD31813684
[MOL File]

1616413-96-7.mol
[Molecular Weight]

410.47
Chemical PropertiesBack Directory
[density ]

1.42±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in DMSO
[form ]

Solid
[pka]

13.36±0.70(Predicted)
[color ]

White to off-white
[InChIKey]

WRONAJQPZWDYAR-ZDUSSCGKSA-N
[SMILES]

N1(C(NC2=CC=C(OC)C=C2C)=O)CCN(C2N=C(N)N=C3N(C)N=CC3=2)[C@@H](C)C1
Hazard InformationBack Directory
[Uses]

UCB9608 is a potent, selective and orally active PI4KIIIβ inhibitor, with an IC50 of 11 nM, selective over PI3KC2 α, β, and γ lipid kinases. UCB9608 improves metabolic stability and exhibits excellent pharmacokinetic profile, acts as a potent immunosuppressive agent[1].
[References]

[1] Reuberson J, et al. Discovery of a Potent, Orally Bioavailable PI4KIIIβ Inhibitor (UCB9608) Able To Significantly Prolong Allogeneic Organ Engraftment in Vivo. J Med Chem. 2018 Aug 9;61(15):6705-6723. DOI:10.1021/acs.jmedchem.8b00521
Spectrum DetailBack Directory
[Spectrum Detail]

UCB9608(1616413-96-7)1HNMR
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