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Oxindole

CAT: 0931-Fr16741-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-Fr16741-01Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
59-48-3
Target
Endogenous Metabolite, HIV Protease
Related Pathways
Microbiology/Virology, Metabolism, Proteases/Proteasome
Purity
0.9965
Bioactivity
Oxindole (Indolin-2-one) is an aromatic heterocyclic building block, and its 2-indolinone derivatives are lead compounds in kinase inhibitor research. The oxindole structure is utilized in receptor tyrosine kinase (RTK) inhibitors, such as SU4984 and intedanib, making the RTK family a significant therapeutic target for anti-cancer drug development.
Smiles
O=C1CC2=C(N1)C=CC=C2
Molecular Formula
C8H7NO
Molecular Weight
133.15
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Oxindole

Indolin-2-one is an indolinone carrying an oxo group at position 2. It is an indolinone and a gamma-lactam.

CAS Number59-48-3
PubChem CID321710
IUPAC Name1,3-dihydroindol-2-one
Molecular FormulaC8H7NO
Molecular Weight133.15
XLogP1.2
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity155
SMILES
C1C2=CC=CC=C2NC1=O
InChI
InChI=1S/C8H7NO/c10-8-5-6-3-1-2-4-7(6)9-8/h1-4H,5H2,(H,9,10)
InChIKey
JYGFTBXVXVMTGB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Oxindole
CAS: 59-48-3
CID: 321710
Formula: C8H7NO
MW: 133.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight133.15
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass133.052763847
Monoisotopic Mass133.052763847
Topological Polar Surface Area29.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity155
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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