(S)-5-Chloro-3-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-7-(1-(3,4,5-trifluorophenyl)ethyl)-7HH-pyrazolo[3,4-b]pyridine CAS 1160358-91-7
| CAS No. | 1160358-91-7 |
| Molecular Formula | C25H19ClF3N5O |
| Molecular Weight | 497.90 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of (S)-5-Chloro-3-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-7-(1-(3,4,5-trifluorophenyl)ethyl)-7HH-pyrazolo[3,4-b]pyridine is closely related to a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
(S)-5-Chloro-3-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-7-(1-(3,4,5-trifluorophenyl)ethyl)-7HH-pyrazolo[3,4-b]pyridine (CAS 1160358-91-7), molecular formula C25H19ClF3N5O and molecular weight 497.90 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, (S)-5-Chloro-3-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-7-(1-(3,4,5-trifluorophenyl)ethyl)-7HH-pyrazolo[3,4-b]pyridine (C25H19ClF3N5O) contains a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 17.0, corresponding to approximately 17 ring(s) or double-bond equivalent(s). With a molecular weight of 497.90 g/mol, it falls into the moderately-high-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
As a certified reference material (CRM), (S)-5-Chloro-3-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-7-(1-(3,4,5-trifluorophenyl)ethyl)-7HH-pyrazolo[3,4-b]pyridine meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C25H19ClF3N5O |
| Molecular Weight | 497.90 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 17.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1989 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 5 |
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- tert-Butyl ((1-((2,4-dichloropyrimidin-5-yl)methyl)piperidin-4-yl)methyl)carbamate (CAS 1420987-11-6)
- 2-Methyl-4H-furo[3,2-b]pyrrole-5-carbohydrazide (CAS 168837-89-6)
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