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Wnt/ß-catenin agonist 2

CAT: 0127-BUP09377-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP09377-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
943820-93-7
Purity
=98%
Smiles
O=C(NCCn1cccn1)c1cc(on1)-c1ccco1

Chemical Information

Wnt/|A-catenin agonist 2
CAS Number943820-93-7
PubChem CID24740085
IUPAC Name5-(furan-2-yl)-N-(2-pyrazol-1-ylethyl)-1,2-oxazole-3-carboxamide
Molecular FormulaC13H12N4O3
Molecular Weight272.26
XLogP0.7
Topological Polar Surface Area86.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity342
SMILES
C1=CN(N=C1)CCNC(=O)C2=NOC(=C2)C3=CC=CO3
InChI
InChI=1S/C13H12N4O3/c18-13(14-5-7-17-6-2-4-15-17)10-9-12(20-16-10)11-3-1-8-19-11/h1-4,6,8-9H,5,7H2,(H,14,18)
InChIKey
IXPRTBBVBMTJDL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Wnt/|A-catenin agonist 2
CAS: 943820-93-7
CID: 24740085
Formula: C13H12N4O3
MW: 272.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight272.26
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass272.09094026
Monoisotopic Mass272.09094026
Topological Polar Surface Area86.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity342
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes