(2S)-N-Benzhydryl-2-(3-(2-(2,5-diphenyl-1H-pyrrol-1-yl)cyclohexyl)thioureido)-N,3,3-trimethylbutanamide CAS 2415742-05-9
| CAS No. | 2415742-05-9 |
| Molecular Formula | C43H48N4OS |
| Molecular Weight | 668.93 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of (2S)-N-Benzhydryl-2-(3-(2-(2,5-diphenyl-1H-pyrrol-1-yl)cyclohexyl)thioureido)-N,3,3-trimethylbutanamide is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
(2S)-N-Benzhydryl-2-(3-(2-(2,5-diphenyl-1H-pyrrol-1-yl)cyclohexyl)thioureido)-N,3,3-trimethylbutanamide (CAS 2415742-05-9), molecular formula C43H48N4OS and molecular weight 668.93 g/mol, is a CATO reference standard with documented purity and traceability.
(2S)-N-Benzhydryl-2-(3-(2-(2,5-diphenyl-1H-pyrrol-1-yl)cyclohexyl)thioureido)-N,3,3-trimethylbutanamide (C43H48N4OS) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage. Its physicochemical properties are representative of its class; these physicochemical properties determine the optimal preparation and storage of its standard solutions. 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 Formula | C43H48N4OS |
| Molecular Weight | 668.93 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 22.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2000 |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 1 |
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