SKL2001

CAT: 0127-BUP13360-06Size: 200 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP13360-06Size:200 mg

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

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CAS Number

909089-13-0

Purity

=95%

Smiles

O=C(NCCCn1ccnc1)c1cc(on1)-c1ccco1

Chemical Information

5-Furan-2yl-isoxazole-3-carboxylic acid (3-imidazol-1yl-propyl)-amide

an agonist of the Wnt-beta-catenin pathway; structure in first source

CAS Number	909089-13-0
PubChem CID	16003447
IUPAC Name	5-(furan-2-yl)-N-(3-imidazol-1-ylpropyl)-1,2-oxazole-3-carboxamide
Molecular Formula	C14H14N4O3
Molecular Weight	286.29
XLogP	0.8
Topological Polar Surface Area	86.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	21
Formal Charge	0
Complexity	355

SMILES

C1=COC(=C1)C2=CC(=NO2)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C14H14N4O3/c19-14(16-4-2-6-18-7-5-15-10-18)11-9-13(21-17-11)12-3-1-8-20-12/h1,3,5,7-10H,2,4,6H2,(H,16,19)

InChIKey

PQXINDBPUDNMPE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 909089-13-0

CID: 16003447

Formula: C14H14N4O3

MW: 286.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	286.29
XLogP3	0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	286.10659032
Monoisotopic Mass	286.10659032
Topological Polar Surface Area	86.1 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	355
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
HY-101085-01	SKL2001