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INDY

CAT: 0013-GTR19174419-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19174419-01Size:5 mg
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Description
INDY is a potent and selective ATP-competitive inhibitor of Dyrk1A and Dyrk1B kinases, exhibiting IC50 values of 0.24 μM and 0.23 μM, respectively. This small molecule is a valuable research tool for studying DYRK family kinase function in cellular models and investigating related pathways in neuroscience and cancer research.
CAS Number
1169755-45-6
Product Name Alternative
1- (3-ethyl-5-hydroxy-1,3-benzothiazol-2-ylidene) propan-2-one, Dyrk1B, Dyrk1A, INDY
Field of Research
Cell Biology, Signal Transduction
Purity
98.15% (May vary between batches)
Solubility
DMSO:5 mg/mL (21.25 mM)
Smiles
CCN1\C (Sc2ccc (O) cc12) =C\C (C) =O
Molecular Formula
C12H13NO2S
Molecular Weight
235.3
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(1z)-1-(3-Ethyl-5-Hydroxy-1,3-Benzothiazol-2(3h)-Ylidene)propan-2-One

INDY is a member of the class of benzothiazoles that is 2,3-dihydro-1,3-benzothiazole substituted by 2-oxopropylidene, ethyl, and hydroxy groups at positions 2, 3 and 5, respectively. It is an ATP-competitive inhibitor of Dyrk1A and Dyrk1B (IC50 of 0.24 M and 0.23 M, respectively). It has a role as an EC 2.7.12.1 (dual-specificity kinase) inhibitor, an antineoplastic agent and a drug metabolite. It is an organic hydroxy compound, a member of benzothiazoles and an enone.

CAS Number1169755-45-6
PubChem CID44136031
IUPAC Name(1Z)-1-(3-ethyl-5-hydroxy-1,3-benzothiazol-2-ylidene)propan-2-one
Molecular FormulaC12H13NO2S
Molecular Weight235.30
XLogP2.2
Topological Polar Surface Area65.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity316
SMILES
CCN\1C2=C(C=CC(=C2)O)S/C1=C\C(=O)C
InChI
InChI=1S/C12H13NO2S/c1-3-13-10-7-9(15)4-5-11(10)16-12(13)6-8(2)14/h4-7,15H,3H2,1-2H3/b12-6-
InChIKey
GCSZJMUFYOAHFY-SDQBBNPISA-N
Chemical Structure
2D Structure
2D structure of (1z)-1-(3-Ethyl-5-Hydroxy-1,3-Benzothiazol-2(3h)-Ylidene)propan-2-One
CAS: 1169755-45-6
CID: 44136031
Formula: C12H13NO2S
MW: 235.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight235.30
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass235.06669983
Monoisotopic Mass235.06669983
Topological Polar Surface Area65.8 Ų
Heavy Atom Count16
Formal Charge0
Complexity316
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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