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Chemical structure of Glycolic acid oxidase inhibitor 1

GC31381

Glycolic acid oxidase inhibitor 1

Also known as 3-[4-(4-bromophenyl)phenyl]-4-hydroxypyrrole-2,5-dione

Glycolic acid oxidase inhibitor 1 is a glycolate oxidase inhibitor, extracted from patent EP0021228A1, in Table IV

ChemicalCAS77529-42-1MW344.16FormulaC16H10BrNO3
CAS number
77529-42-1
Molecular weight
344.16
Formula
C16H10BrNO3
Solubility
DMSO : ≥ 137 mg/mL (398·07 mM)
InChIKey
WMLWRZOUOGMDNS-UHFFFAOYSA-N
Catalogue number
GC31381
Brand
GLPBIO
Computed properties PubChem CID 54702980 · XLogP 3.1 · TPSA 66.4 Ų · H-bond donors 2
XLogP
3.1
TPSA
66.4 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21

SMILES C1=CC(=CC=C1C2=CC=C(C=C2)Br)C3=C(C(=O)NC3=O)O

Computed descriptors from PubChem (CID 54702980), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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