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8BTC

CAT: 0931-T209546-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T209546-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3064070-24-9
Target
Wnt/beta-catenin
Related Pathways
Stem Cells, Cytoskeletal Signaling
Bioactivity
8BTC (compound 4w) is a potent covalent Notum inhibitor with an IC50 value of 2.5 nM.
Smiles
O=C(N1C2=CC=C(Cl)C(Cl)=C2CC1)C
Molecular Formula
C10H9Cl2NO
Molecular Weight
230.09
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-[4,5-Bis(chloranyl)-2,3-dihydroindol-1-yl]ethanone
CAS Number3064070-24-9
PubChem CID166001321
IUPAC Name1-(4,5-dichloro-2,3-dihydroindol-1-yl)ethanone
Molecular FormulaC10H9Cl2NO
Molecular Weight230.09
XLogP2.6
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity246
SMILES
CC(=O)N1CCC2=C1C=CC(=C2Cl)Cl
InChI
InChI=1S/C10H9Cl2NO/c1-6(14)13-5-4-7-9(13)3-2-8(11)10(7)12/h2-3H,4-5H2,1H3
InChIKey
FSLARAPYXMNEFP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-[4,5-Bis(chloranyl)-2,3-dihydroindol-1-yl]ethanone
CAS: 3064070-24-9
CID: 166001321
Formula: C10H9Cl2NO
MW: 230.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight230.09
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass229.0061193
Monoisotopic Mass229.0061193
Topological Polar Surface Area20.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity246
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

Alternative Products

CatalogName
GTR19262191-018BTC

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