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Chemical structure of YJC-10592

GB40422

YJC-10592

Also known as N-[2-[[(3R)-1-[2-[4-(2-chlorobenzoyl)piperazin-1-yl]ethyl]pyrrolidin-3-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide

YJC-10592 is a CC chemokine receptor 2 (CCR2) antagonist (IC50 value 1·12 μM), which also showed excellent inhibitory activity in the calcium assay (IC50 value 1·7 nM), and good potency in the chemotA1is assay (IC50 value 23 nM)· In rats, YJC-10592 showed dose-dependent pharmacokinetics and low F value due to slower elimination and incomplete absorption

ChemicalCAS1226894-87-6MW566.01FormulaC27H31ClF3N5O3
CAS number
1226894-87-6
Molecular weight
566.01
Formula
C27H31ClF3N5O3
InChIKey
HTXMSBSZASVVFP-OAQYLSRUSA-N
Catalogue number
GB40422
Brand
GLPBIO
Computed properties PubChem CID 46830335 · XLogP 3.3 · TPSA 85 Ų · H-bond donors 2
XLogP
3.3
TPSA
85 Ų
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
39

SMILES C1CN(C[C@@H]1NC(=O)CNC(=O)C2=CC(=CC=C2)C(F)(F)F)CCN3CCN(CC3)C(=O)C4=CC=CC=C4Cl

Computed descriptors from PubChem (CID 46830335), 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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