Cas no 147849-82-9 (6-tert-butyl-2,3-dihydropyridazin-3-one)

6-tert-Butyl-2,3-dihydropyridazin-3-one is a heterocyclic compound featuring a pyridazinone core with a tert-butyl substituent at the 6-position. This structure imparts stability and potential reactivity, making it a valuable intermediate in organic synthesis and pharmaceutical research. The tert-butyl group enhances steric and electronic properties, influencing regioselectivity in further functionalization. Its dihydropyridazinone scaffold is of interest in medicinal chemistry due to its relevance in bioactive molecule design. The compound exhibits moderate solubility in common organic solvents, facilitating its use in various synthetic applications. Its well-defined structure and purity make it suitable for exploratory studies in drug discovery and material science.
6-tert-butyl-2,3-dihydropyridazin-3-one structure
147849-82-9 structure
Product Name:6-tert-butyl-2,3-dihydropyridazin-3-one
CAS No:147849-82-9
MF:C8H12N2O
MW:152.193681716919
CID:1319305
PubChem ID:2802164
Update Time:2025-06-08

6-tert-butyl-2,3-dihydropyridazin-3-one Chemical and Physical Properties

Names and Identifiers

    • 3-tert-butyl-1h-pyridazin-6-one
    • 6-tert-butyl-2,3-dihydropyridazin-3-one
    • 3(2H)-Pyridazinone, 6-(1,1-dimethylethyl)-
    • AC1MCWXH
    • AC1Q1MEF
    • Maybridge4_000681
    • SureCN2627805
    • SureCN3176447
    • ACMC-1C682
    • 6-(TERT-BUTYL)PYRIDAZIN-3(2H)-ONE
    • HMS1522O21
    • DB-369391
    • TUDXTYPISQDTPK-UHFFFAOYSA-N
    • 147849-82-9
    • EN300-66802
    • SR-01000634225-1
    • IDI1_031263
    • CCG-44386
    • DTXSID50384342
    • F8889-3587
    • AKOS008135766
    • 6-TERT-BUTYL-2H-PYRIDAZIN-3-ONE
    • 6-tert-butylpyridazin-3(2H)-one
    • SCHEMBL2627805
    • BRD-K68940208-001-01-9
    • Z432063054
    • F51252
    • MDL: MFCD01312126
    • Inchi: 1S/C8H12N2O/c1-8(2,3)6-4-5-7(11)10-9-6/h4-5H,1-3H3,(H,10,11)
    • InChI Key: TUDXTYPISQDTPK-UHFFFAOYSA-N
    • SMILES: O=C1C=CC(C(C)(C)C)=NN1

Computed Properties

  • Exact Mass: 152.09506
  • Monoisotopic Mass: 152.094963011g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 233
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 41.5?2

Experimental Properties

  • PSA: 41.46

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6-tert-butyl-2,3-dihydropyridazin-3-one Suppliers

Amadis Chemical Company Limited
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(CAS:147849-82-9)6-tert-butyl-2,3-dihydropyridazin-3-one
Order Number:A1063554
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 18:27
Price ($):339.0

Additional information on 6-tert-butyl-2,3-dihydropyridazin-3-one

Introduction to 6-tert-butyl-2,3-dihydropyridazin-3-one (CAS No. 147849-82-9)

6-tert-butyl-2,3-dihydropyridazin-3-one, with the Chemical Abstracts Service (CAS) number 147849-82-9, is a compound that has garnered significant attention in the fields of medicinal chemistry and pharmaceutical research. This compound belongs to the class of pyridazines, which are six-membered heterocyclic compounds containing two nitrogen atoms. The presence of the tert-butyl group and the dihydropyridazine structure imparts unique chemical and biological properties to this molecule, making it a valuable candidate for various applications.

The chemical structure of 6-tert-butyl-2,3-dihydropyridazin-3-one is characterized by a six-membered ring with two nitrogen atoms at positions 1 and 4, and a tert-butyl group attached to the carbon at position 6. The dihydropyridazine structure indicates that the ring is partially saturated, with a double bond between the nitrogen atoms. This structural configuration contributes to its stability and reactivity, which are crucial factors in its potential pharmaceutical applications.

Recent studies have explored the biological activities of 6-tert-butyl-2,3-dihydropyridazin-3-one, revealing its potential as a therapeutic agent. One notable area of research is its anti-inflammatory properties. In vitro and in vivo studies have demonstrated that this compound can effectively inhibit the production of pro-inflammatory cytokines such as interleukin-6 (IL-6) and tumor necrosis factor-alpha (TNF-α). These findings suggest that 6-tert-butyl-2,3-dihydropyridazin-3-one could be a promising candidate for the treatment of inflammatory diseases such as rheumatoid arthritis and inflammatory bowel disease.

In addition to its anti-inflammatory effects, 6-tert-butyl-2,3-dihydropyridazin-3-one has also shown potential as an antioxidant. Oxidative stress is a key factor in the development of various diseases, including neurodegenerative disorders and cardiovascular diseases. Research has indicated that this compound can scavenge free radicals and reduce oxidative damage, thereby protecting cells from oxidative stress-induced injury. This property makes it a potential therapeutic agent for conditions where oxidative stress plays a significant role.

The pharmacokinetic properties of 6-tert-butyl-2,3-dihydropyridazin-3-one have also been investigated. Studies have shown that it has good oral bioavailability and favorable pharmacokinetic profiles, which are essential for its development as an oral medication. The compound's ability to cross the blood-brain barrier has also been evaluated, indicating its potential for treating central nervous system (CNS) disorders.

Clinical trials are currently underway to further evaluate the safety and efficacy of 6-tert-butyl-2,3-dihydropyridazin-3-one. Preliminary results from phase I trials have demonstrated that it is well-tolerated by patients with minimal side effects. These findings are encouraging and support the continued development of this compound as a potential therapeutic agent.

In conclusion, 6-tert-butyl-2,3-dihydropyridazin-3-one (CAS No. 147849-82-9) is a promising compound with diverse biological activities. Its anti-inflammatory and antioxidant properties make it a valuable candidate for the treatment of various diseases. Ongoing research and clinical trials will provide further insights into its therapeutic potential and pave the way for its use in clinical practice.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:147849-82-9)6-tert-butyl-2,3-dihydropyridazin-3-one
A1063554
Purity:99%
Quantity:1g
Price ($):339.0
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