UBP301

CAT: 0931-T23489Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0931-T23489Size:1 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

569371-10-4

Target

IGluR, Others

Related Pathways

Neuroscience, Others, Membrane transporter/Ion channel

Bioactivity

UBP301 is a kainate receptor antagonist.

Smiles

C(N1C(=O)N(C[C@@H](C(O)=O)N)C=C(I)C1=O)C2=CC=C(C(O)=O)C=C2

Molecular Formula

C15H14IN3O6

Molecular Weight

459.19

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

4-[[3-[(2S)-2-amino-2-carboxyethyl]-5-iodo-2,6-dioxopyrimidin-1-yl]methyl]benzoic acid

CAS Number	569371-10-4
PubChem CID	6604913
IUPAC Name	4-[[3-[(2S)-2-amino-2-carboxyethyl]-5-iodo-2,6-dioxopyrimidin-1-yl]methyl]benzoic acid
Molecular Formula	C15H14IN3O6
Molecular Weight	459.19
XLogP	-2.5
Topological Polar Surface Area	141
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Heavy Atom Count	25
Formal Charge	0
Complexity	614

SMILES

C1=CC(=CC=C1CN2C(=O)C(=CN(C2=O)C[C@@H](C(=O)O)N)I)C(=O)O

InChI

InChI=1S/C15H14IN3O6/c16-10-6-18(7-11(17)14(23)24)15(25)19(12(10)20)5-8-1-3-9(4-2-8)13(21)22/h1-4,6,11H,5,7,17H2,(H,21,22)(H,23,24)/t11-/m0/s1

InChIKey

JHSYCOCOIYSZGI-NSHDSACASA-N

Chemical Structure

2D Structure

CAS: 569371-10-4

CID: 6604913

Formula: C15H14IN3O6

MW: 459.19

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	459.19
XLogP3	-2.5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	458.99273
Monoisotopic Mass	458.99273
Topological Polar Surface Area	141 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	614
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
GTR19200716	UBP301
HY-107606A-01	UBP301 (hydrochloride)

UBP301

Chemical Information

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