CAS 28735-21-9 3-Methylthio-1,2,4-triazine - Materials / Alfa Chemistry

NAVIGATION

3-Methylthio-1,2,4-triazine

PRICE INQUIRY

Catalog Number

ACM28735219-1

CAS Number

28735-21-9

Product Name

3-Methylthio-1,2,4-triazine

Category

Other Glass and Ceramic Materials

Synonyms

METHYL 1,2,4-TRIAZIN-3-YL SULFIDE;3-METHYLTHIO-1,2,4-TRIAZINE

IUPAC Name

3-methylsulfanyl-1,2,4-triazine

Molecular Weight

127.17g/mol

Molecular Formula

C4H5N3S

Canonical SMILES

CSC1=NC=CN=N1

InChI

InChI=1S/C4H5N3S/c1-8-4-5-2-3-6-7-4/h2-3H,1H3

InChI Key

NFHGWQLAJYTULJ-UHFFFAOYSA-N

Density

1.28 g/cm³

Application

3-Methylthio-1,2,4-triazine serves the purpose of acting as a phosphodiesterase type 5 (PDE5) inhibitor, thanks to its phenyl ring, which makes it a valuable component in pharmaceutical applications. When reacted with potassium amide in liquid ammonia, it yields several derivatives such as 3-amino-1,2,4-triazine, 3,3'-bis(methylthio)-5,5'-bis-1,2,4-triazine, and 3-amino-3'-(methylthio)-5,5'-bis-1,2,4-triazine. These derivatives are instrumental in the preparation of various pharmaceutical products, demonstrating the versatile nature of 3-Methylthio-1,2,4-triazine in medicinal chemistry.

Complexity

68.3

Covalently-Bonded Unit Count

Exact Mass

127.020418g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

127.020418g/mol

NSC Number

276290

Rotatable Bond Count