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CS-W001157 4
Total: USD 88.00

5,6,7,8-Tetrahydro-1,6-naphthyridin-2(1H)-one

  • CAS No. 676994-64-2

  • Cat. No. CS-W007082
  • Purity≥97%
  • MDL No.MFCD10575012

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

5,6,7,8-Tetrahydro-1,6-naphthyridin-2(1H)-one|CS-W007082

Structure of 676994-64-2

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General Information

  • CAS No. 676994-64-2
  • Cat. No. CS-W007082
  • Purity ≥97%
  • MDL No. MFCD10575012
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀N₂O
  • Molecular Weight 150.18
  • Synonym(s) 5,6,7,8-Tetrahydro-1H-1,6phthyridin-2-one
  • SMILES O=C1NC2=C(CNCC2)C=C1

Description

5,6,7,8-Tetrahydro-1,6-naphthyridin-2(1H)-one features a saturated heterocyclic core that enhances solubility and metabolic stability. This scaffold integrates readily into medicinal chemistry libraries, offering a rigid, electron-rich platform for target-directed optimization. The ketone functionality enables direct derivatization and coordination in transition-metal-catalyzed transformations.

Application

5,6,7,8-Tetrahydro-1,6-naphthyridin-2(1H)-one serves as a versatile heterocyclic building block in medicinal chemistry, enabling the synthesis of bioactive scaffolds through standard functionalization at the 2-position. Its saturated pyridine ring enhances metabolic stability and solubility, while the lactam carbonyl supports hydrogen bonding and structural rigidity. The compound exhibits excellent bench stability and compatibility with common coupling reactions, facilitating efficient access to analogs via amide formation, reductive amination, or electrophilic substitution.

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   41.46
  • LogP   0.2774
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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