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UBP 296

CAT: 0013-GTR19200717-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19200717-02Size:50 mg
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Description
This small molecule is a selective antagonist of kainate receptors containing the GluR5 (Grik1) subunit. It is a valuable research tool for investigating the role of these receptors in neurological processes, including pain signaling and epilepsy, in both in vitro and in vivo experimental models.
CAS Number
745055-86-1
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
C (N1C (=O) N (CC (C (O) =O) N) C=CC1=O) C2=C (C (O) =O) C=CC=C2
Molecular Formula
C15H15N3O6
Molecular Weight
333.3
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(RS)-1-(2-amino-2-carboxyethyl)-3-(2-carboxybenzyl)pyrimidine-2,4-dione

2-[[3-(2-amino-2-carboxyethyl)-2,6-dioxo-1-pyrimidinyl]methyl]benzoic acid is an alpha-amino acid.

CAS Number745055-86-1
PubChem CID11674376
IUPAC Name2-[[3-(2-amino-2-carboxyethyl)-2,6-dioxopyrimidin-1-yl]methyl]benzoic acid
Molecular FormulaC15H15N3O6
Molecular Weight333.30
XLogP-3.2
Topological Polar Surface Area141
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity576
SMILES
C1=CC=C(C(=C1)CN2C(=O)C=CN(C2=O)CC(C(=O)O)N)C(=O)O
InChI
InChI=1S/C15H15N3O6/c16-11(14(22)23)8-17-6-5-12(19)18(15(17)24)7-9-3-1-2-4-10(9)13(20)21/h1-6,11H,7-8,16H2,(H,20,21)(H,22,23)
InChIKey
UUIYULWYHDSXHL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (RS)-1-(2-amino-2-carboxyethyl)-3-(2-carboxybenzyl)pyrimidine-2,4-dione
CAS: 745055-86-1
CID: 11674376
Formula: C15H15N3O6
MW: 333.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight333.30
XLogP3-3.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass333.09608521
Monoisotopic Mass333.09608521
Topological Polar Surface Area141 Ų
Heavy Atom Count24
Formal Charge0
Complexity576
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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