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INDY

CAT: 0957-S8395-5mgSize: 5 mgDry Ice: NoHazardous: No
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CAT#:0957-S8395-5mgSize:5 mg
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CAS Number
1169755-45-6
Target
DYRK
Applications
Protein Tyrosine Kinase
Molecular Formula
C12H13NO2S
Additionnal Information
INDY, a benzothiazole derivative is a potent and ATP-competitive inhibitor of Dyrk1A and Dyrk1B with an IC50 value of 0.24 μM and Ki value of 0.18 μM, respectively. INDY diminishes the self-renewal capacity of normal and tumorigenic cells in primary Glioblastoma (GBM) cell lines and neural progenitor cells.

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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MBS9015408Rabbit anti-Drosophila melanogaster (Fruit fly) Indy Polyclonal Antibody
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