structure of 5-tert-Butyl 7-ethyl 6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5,7(4H)-dicarboxylate

5-tert-Butyl 7-ethyl 6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5,7(4H)-dicarboxylate

CAS No.: 1000994-24-0
M. Wt: 295.33400
M. Fa: C14H21N3O4
InChI Key: NDPZNTWXVIAYLR-UHFFFAOYSA-N

Names and Identifiers of 1000994-24-0

CAS Number

1000994-24-0

IUPAC Name

5-O-tert-butyl 7-O-ethyl 1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5,7-dicarboxylate

InChI

InChI=1S/C14H21N3O4/c1-5-20-12(18)10-8-17(13(19)21-14(2,3)4)7-9-6-15-16-11(9)10/h6,10H,5,7-8H2,1-4H3,(H,15,16)

InChIKey

NDPZNTWXVIAYLR-UHFFFAOYSA-N

Canonical SMILES

CCOC(=O)C1CN(CC2=C1NN=C2)C(=O)OC(C)(C)C

Physical and chemical properties of 1000994-24-0

Exact Mass

295.15300

LogP

1.74500

Molecular Formula

C14H21N3O4

Molecular Weight

295.33400

PSA

84.52000

Applications of 1000994-24-0

5-tert-butyl 7-ethyl 6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5,7(4H)-dicarboxylate has potential applications in several fields:

  • Medicinal Chemistry: As a scaffold for developing new pharmaceuticals targeting various diseases.
  • Organic Synthesis: Used as an intermediate in the synthesis of more complex organic molecules.
  • Material Science: Potential use in developing specialty chemicals and materials due to its unique properties.

Research into its applications continues as more is understood about its chemical behavior and biological interactions.

Biological Activity of 1000994-24-0

  • Antimicrobial activity: Some derivatives exhibit inhibition against bacterial and fungal strains.
  • Anticancer properties: Certain pyrazolo[4,3-c]pyridine derivatives have been investigated for their ability to inhibit tumor growth.
  • Enzyme inhibition: Compounds in this class may interact with specific enzymes, potentially modulating their activity.

Further research is necessary to elucidate the specific biological mechanisms and therapeutic potential of this compound.