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Chemical structure of Q94 hydrochloride

GC17172

Q94 hydrochloride

Also known as 2-benzyl-1-[(4-chlorophenyl)methyl]benzimidazole;hydrochloride

PAR1 negative allosteric modulator

ChemicalCAS1052076-77-3MW369.29FormulaC21H17ClN2·HCl
CAS number
1052076-77-3
Molecular weight
369.29
Formula
C21H17ClN2·HCl
Solubility
＜18·46mg/ml in DMSO; ＜18·46mg/ml in ethanol
InChIKey
WXIWQTVPWYFEHP-UHFFFAOYSA-N
Catalogue number
GC17172
Brand
GLPBIO
Computed properties PubChem CID 16258217 · TPSA 17.8 Ų · H-bond donors 1 · H-bond acceptors 1
TPSA
17.8 Ų
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
25

SMILES C1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl.Cl

Computed descriptors from PubChem (CID 16258217), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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