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Chemical structure of A 205804

GC15557

A 205804

Also known as 4-(4-methylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxamide

A 205804 is a potent and selective lead inhibitor of E-selectin and ICAM-1 expression (E-selectin: IC50 = 20nM; ICAM-1: IC50 = 25nM)

ChemicalCAS251992-66-2MW300.39FormulaC15H12N2OS2
CAS number
251992-66-2
Molecular weight
300.39
Formula
C15H12N2OS2
Solubility
≥ 30mg/mL in DMSO
InChIKey
QQGWEXFLMJGCAL-UHFFFAOYSA-N
Catalogue number
GC15557
Brand
GLPBIO
Computed properties PubChem CID 9839311 · XLogP 3.5 · TPSA 110 Ų · H-bond donors 1
XLogP
3.5
TPSA
110 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20

SMILES CC1=CC=C(C=C1)SC2=C3C=C(SC3=CN=C2)C(=O)N

Computed descriptors from PubChem (CID 9839311), 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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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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