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Chemical structure of Anti-inflammatory agent 2

GC32009

Anti-inflammatory agent 2

Also known as 2-cycloheptyl-N-methylsulfonyl-2-[4-(quinolin-2-ylmethoxy)phenyl]acetamide

Anti-inflammatory agent 2 (Compound 6) is a leukotriene synthesis (LTB4) inhibitor with an IC50 of 70 nM

ChemicalCAS133012-00-7MW466.59FormulaC26H30N2O4S
CAS number
133012-00-7
Molecular weight
466.59
Formula
C26H30N2O4S
Solubility
Soluble in DMSO
InChIKey
YAWBFCPZMALJCE-UHFFFAOYSA-N
Catalogue number
GC32009
Brand
GLPBIO
Computed properties PubChem CID 9869161 · XLogP 5.8 · TPSA 93.7 Ų · H-bond donors 1
XLogP
5.8
TPSA
93.7 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
33

SMILES CS(=O)(=O)NC(=O)C(C1CCCCCC1)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

Computed descriptors from PubChem (CID 9869161), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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Documents
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