12-{2-methylpyrazolo[1,5-a]pyrimidin-7-yl}-8-thia-1,10-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,9,11-pentaen-13-one CAS 691868-70-9

Purity 97%+In StockPharmaceutical Standards
CAS No.691868-70-9
Molecular FormulaC17H11N5OS
Molecular Weight333.37 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

12-{2-methylpyrazolo[1,5-a]pyrimidin-7-yl}-8-thia-1,10-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,9,11-pentaen-13-one CAS 691868-70-9 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 333.37 g/mol gives 12-{2-methylpyrazolo[1,5-a]pyrimidin-7-yl}-8-thia-1,10-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,9,11-pentaen-13-one distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

12-{2-methylpyrazolo[1,5-a]pyrimidin-7-yl}-8-thia-1,10-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,9,11-pentaen-13-one (CAS 691868-70-9) is a high-purity analytical reference standard with the molecular formula C17H11N5OS and a molecular weight of 333.37 g/mol.

The molecular framework of 12-{2-methylpyrazolo[1,5-a]pyrimidin-7-yl}-8-thia-1,10-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,9,11-pentaen-13-one (C17H11N5OS) is characterized by a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC17H11N5OS
Molecular Weight333.37 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)15.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1985
Nitrogen Atoms5
Sulfur Atoms1

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