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Chemical structure of VU 29

GC17289

VU 29

Also known as N-(1,3-diphenylpyrazol-5-yl)-4-nitrobenzamide

mGlu5 allosteric potentiator

ChemicalCAS890764-36-0MW384.39FormulaC22H16N4O3
CAS number
890764-36-0
Molecular weight
384.39
Formula
C22H16N4O3
Solubility
<38·44mg/ml in DMSO
InChIKey
KIALCSMRIHRFPL-UHFFFAOYSA-N
Catalogue number
GC17289
Brand
GLPBIO
Computed properties PubChem CID 11610682 · XLogP 4.6 · TPSA 92.7 Ų · H-bond donors 1
XLogP
4.6
TPSA
92.7 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
29

SMILES C1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Computed descriptors from PubChem (CID 11610682), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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