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Chemical structure of CCR4 antagonist 3

GC64441

CCR4 antagonist 3

Also known as 1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[3-[(3R)-1-(2-hydroxyethyl)piperidin-3-yl]azetidin-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile

CCR4 antagonist 3 is an orally active, potent and selective CCR4 antagonist· CCR4 antagonist 3, featuring a novel piperidinyl-azetidine motif, has IC50s of 22 nM and 50 nM in the calcium flux and CTX assay· CCR4 antagonist 3 has antitumor activity

ChemicalCAS2174938-70-4MW500.42FormulaC24H27Cl2N7O
CAS number
2174938-70-4
Molecular weight
500.42
Formula
C24H27Cl2N7O
Solubility
DMSO ： 190 mg/mL (379·68 mM; Need ultrasonic)
InChIKey
PNCGVFJZWKHMCL-CVEARBPZSA-N
Catalogue number
GC64441
Brand
GLPBIO
Computed properties PubChem CID 134225255 · XLogP 3.7 · TPSA 94.1 Ų · H-bond donors 1
XLogP
3.7
TPSA
94.1 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
34

SMILES C[C@H](C1=C(C=C(C=C1)Cl)Cl)N2C3=NC(=CN=C3C(=N2)C#N)N4CC(C4)[C@H]5CCCN(C5)CCO

Computed descriptors from PubChem (CID 134225255), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.