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CAY10761

CAT: 0013-GTR19190424-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19190424-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CAY10761 is a small molecule inhibitor of ENPP1 and also inhibits mushroom tyrosinase and various ureases. This compound is used in biochemical research to study nucleotide metabolism, melanogenesis, and microbial pathogenesis in in vitro enzymatic assays.
CAS Number
333409-31-7
Field of Research
Metabolism Research, Protein Biochemistry
Smiles
C (CCC=1OC (=S) NN1) C=2OC (=S) NN2
Molecular Formula
C7H8N4O2S2
Molecular Weight
244.29
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-[3-(5-Mercapto-1,3,4-oxadiazol-2-yl)propyl]-1,3,4-oxadiazole-2-thiol
CAS Number333409-31-7
PubChem CID2729453
IUPAC Name5-[3-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)propyl]-3H-1,3,4-oxadiazole-2-thione
Molecular FormulaC7H8N4O2S2
Molecular Weight244.3
XLogP0.7
Topological Polar Surface Area131
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity332
SMILES
C(CC1=NNC(=S)O1)CC2=NNC(=S)O2
InChI
InChI=1S/C7H8N4O2S2/c14-6-10-8-4(12-6)2-1-3-5-9-11-7(15)13-5/h1-3H2,(H,10,14)(H,11,15)
InChIKey
XQFRUIPQODDPMN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-[3-(5-Mercapto-1,3,4-oxadiazol-2-yl)propyl]-1,3,4-oxadiazole-2-thiol
CAS: 333409-31-7
CID: 2729453
Formula: C7H8N4O2S2
MW: 244.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight244.3
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass244.00886786
Monoisotopic Mass244.00886786
Topological Polar Surface Area131 Ų
Heavy Atom Count15
Formal Charge0
Complexity332
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

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