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2-Bromo-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one

  • CAS No. 1453799-69-3

  • Cat. No. CS-0097202
  • Purity≥95%
  • MDL No.MFCD28403669

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

2-Bromo-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one|CS-0097202

Structure of 1453799-69-3

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General Information

  • CAS No. 1453799-69-3
  • Cat. No. CS-0097202
  • Purity ≥95%
  • MDL No. MFCD28403669
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇BrN₂O
  • Molecular Weight 215.05
  • Synonym(s) 2-Bromo-6,7-dihydro-5-azaindol-4(5H)-one
  • SMILES O=C1C2=C(NC(Br)=C2)CCN1

Description

This tetrahydro-pyrrolopyridinone scaffold features a brominated position at C2, enabling direct functionalization in late-stage diversification. The electron-deficient core supports efficient cross-coupling reactions under mild conditions, while the lactam carbonyl enhances solubility and enables hydrogen bonding in synthetic intermediates.

Application

2-Bromo-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one serves as a versatile building block for the synthesis of nitrogen-containing heterocycles and bioactive scaffolds. The bromine atom enables palladium-catalyzed cross-coupling reactions, while the pyrrolopyridinone core provides a rigid, electron-deficient platform compatible with diverse functional group transformations. Its bench-stable nature and ease of purification facilitate integration into medicinal chemistry workflows and process-scale applications.

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P405-P501

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Computational Chemistry Data

  • TPSA   44.89
  • LogP   1.0631
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   0

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