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CS-W001157 4
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3-Propan-2-yl-1,3-dihydroindol-2-one

  • CAS No. 4679-87-2

  • Cat. No. CS-0061058
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-Propan-2-yl-1,3-dihydroindol-2-one|CS-0061058

Structure of 4679-87-2

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General Information

  • CAS No. 4679-87-2
  • Cat. No. CS-0061058
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO
  • Molecular Weight 175.23
  • Synonym(s) 3-isopropyloxindole
  • SMILES CC(C1C2=CC=CC=C2NC1=O)C

Description

This indolone derivative features a sterically hindered isopropyl group at the 3-position, enhancing stability and modulating reactivity. The scaffold integrates readily into complex heterocyclic systems, offering a robust platform for medicinal chemistry exploration and synthetic diversification under standard conditions.

Application

3-Isopropyl-1,3-dihydroindol-2-one serves as a versatile scaffold in medicinal chemistry, enabling efficient access to indole-based heterocycles. Its functional group tolerance facilitates downstream derivatization via standard coupling and cyclization protocols. The isopropyl substituent enhances metabolic stability and modulates lipophilicity, improving bioavailability profiles. Bench-stable and readily purified by flash chromatography, it functions as a reliable building block for API intermediates and drug discovery campaigns.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   2.3783
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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