Cas no 57939-39-6 (6-amino-2-(butylsulfanyl)pyrimidin-4-ol)

6-Amino-2-(butylsulfanyl)pyrimidin-4-ol is a pyrimidine derivative with potential applications in pharmaceutical and agrochemical research. Its structure features a sulfanylbutyl substituent at the 2-position and an amino group at the 6-position, contributing to its reactivity and versatility as an intermediate. The compound’s functional groups enable further derivatization, making it valuable for synthesizing heterocyclic compounds with tailored properties. Its stability under standard conditions and solubility in common organic solvents facilitate handling in laboratory settings. This compound may serve as a precursor in the development of bioactive molecules, including kinase inhibitors or antimicrobial agents, due to its pyrimidine core, a scaffold prevalent in medicinal chemistry.
6-amino-2-(butylsulfanyl)pyrimidin-4-ol structure
57939-39-6 structure
Product Name:6-amino-2-(butylsulfanyl)pyrimidin-4-ol
CAS No:57939-39-6
MF:C8H13N3OS
MW:199.273319959641
CID:343706
PubChem ID:135444121
Update Time:2025-06-13

6-amino-2-(butylsulfanyl)pyrimidin-4-ol Chemical and Physical Properties

Names and Identifiers

    • 6-Amino-2-(butylthio)pyrimidin-4-ol
    • 4(1H)-Pyrimidinone, 6-amino-2-(butylthio)-
    • 6-amino-2-(butylthio)-4-pyrimidinol(SALTDATA: FREE)
    • 6-amino-2-butylsulfanyl-1H-pyrimidin-4-one
    • 6-amino-2-butylsulfanyl-3H-pyrimidin-4-one
    • 6-amino-2-butylthiopyrimidin-4-ol
    • 6-amino-2-n-butylsulfanyl-H3-pyrimidin-4-one
    • 6-Amino-2-n-butylthiouracil
    • F0896-0147
    • 6-amino-2-(butylsulfanyl)pyrimidin-4-ol
    • 4-amino-2-butylsulfanyl-1H-pyrimidin-6-one
    • AKOS002350183
    • SCHEMBL3952311
    • CHEMBRDG-BB 5941723
    • 6-amino-2-(butylthio)-4-pyrimidinol
    • EU-0042873
    • CS-0453834
    • 57939-39-6
    • 6-amino-2-butylthiopyrimidin-4(3h)-one
    • AKOS030240156
    • SR-01000474782
    • SR-01000474782-1
    • DTXSID70365875
    • MFCD03536217
    • AKOS002233796
    • CHEMBL85153
    • SB56797
    • MDL: MFCD00725400
    • Inchi: 1S/C8H13N3OS/c1-2-3-4-13-8-10-6(9)5-7(12)11-8/h5H,2-4H2,1H3,(H3,9,10,11,12)
    • InChI Key: BYKCMDUPGDVVKB-UHFFFAOYSA-N
    • SMILES: S(C1=NC(=CC(N1)=O)N)CCCC

Computed Properties

  • Exact Mass: 199.07800
  • Monoisotopic Mass: 199.07793322g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 260
  • 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: 92.8?2

Experimental Properties

  • PSA: 97.33000
  • LogP: 2.23780

6-amino-2-(butylsulfanyl)pyrimidin-4-ol Customs Data

  • HS CODE:2933599090
  • Customs Data:

    China Customs Code:

    2933599090

    Overview:

    2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

6-amino-2-(butylsulfanyl)pyrimidin-4-ol Pricemore >>

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Additional information on 6-amino-2-(butylsulfanyl)pyrimidin-4-ol

Recent Advances in the Study of 6-amino-2-(butylsulfanyl)pyrimidin-4-ol (CAS: 57939-39-6)

6-amino-2-(butylsulfanyl)pyrimidin-4-ol (CAS: 57939-39-6) is a pyrimidine derivative that has garnered significant attention in the field of chemical biology and pharmaceutical research due to its potential therapeutic applications. Recent studies have explored its role as a key intermediate in the synthesis of novel bioactive compounds, particularly in the development of kinase inhibitors and antimicrobial agents. This research brief aims to summarize the latest findings related to this compound, highlighting its chemical properties, biological activities, and potential applications in drug discovery.

One of the most notable advancements in the study of 6-amino-2-(butylsulfanyl)pyrimidin-4-ol is its application in the design of kinase inhibitors. Kinases play a critical role in cellular signaling pathways, and their dysregulation is often associated with various diseases, including cancer and inflammatory disorders. Recent research has demonstrated that derivatives of this compound exhibit potent inhibitory activity against specific kinases, such as cyclin-dependent kinases (CDKs) and mitogen-activated protein kinases (MAPKs). These findings suggest its potential as a scaffold for developing targeted therapies.

In addition to its role in kinase inhibition, 6-amino-2-(butylsulfanyl)pyrimidin-4-ol has also been investigated for its antimicrobial properties. A 2023 study published in the Journal of Medicinal Chemistry reported that this compound and its derivatives exhibit broad-spectrum activity against both Gram-positive and Gram-negative bacteria. The study highlighted its mechanism of action, which involves disrupting bacterial cell wall synthesis and inhibiting essential enzymatic processes. These results underscore its potential as a lead compound for developing new antibiotics, particularly in the face of rising antibiotic resistance.

Another area of interest is the compound's utility in chemical biology as a versatile building block for synthesizing more complex molecules. Researchers have utilized 6-amino-2-(butylsulfanyl)pyrimidin-4-ol as a precursor in the synthesis of heterocyclic compounds with diverse biological activities. For example, a recent study in Bioorganic & Medicinal Chemistry Letters described its use in the development of novel antiviral agents targeting RNA-dependent RNA polymerases. The study demonstrated that modifications to the pyrimidine core could enhance binding affinity and selectivity, paving the way for further optimization.

Despite these promising findings, challenges remain in the development of 6-amino-2-(butylsulfanyl)pyrimidin-4-ol-based therapeutics. Issues such as bioavailability, metabolic stability, and off-target effects need to be addressed through further structural optimization and preclinical studies. However, the compound's unique chemical properties and demonstrated biological activities make it a valuable candidate for continued investigation. Future research directions may include exploring its potential in combination therapies, as well as its application in other disease areas such as neurodegenerative disorders and metabolic diseases.

In conclusion, 6-amino-2-(butylsulfanyl)pyrimidin-4-ol (CAS: 57939-39-6) represents a promising scaffold in chemical biology and drug discovery. Its versatility as a building block, combined with its demonstrated biological activities, positions it as a key focus for ongoing research. As the field advances, further studies will be essential to fully realize its therapeutic potential and translate these findings into clinical applications.

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