trans-N1-[3-[2-[[(3-Chlorophenyl)methyl]amino]-4-pyrimidinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]-1,4-cyclohexanediamine HCl CAS 1386398-50-0
| CAS No. | 1386398-50-0 |
| Molecular Formula | C22H24ClN9 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
CATO manufactures trans-N1-[3-[2-[[(3-Chlorophenyl)methyl]amino]-4-pyrimidinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]-1,4-cyclohexanediamine HCl under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
trans-N1-[3-[2-[[(3-Chlorophenyl)methyl]amino]-4-pyrimidinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]-1,4-cyclohexanediamine HCl (CAS 1386398-50-0), molecular formula C22H24ClN9HCl and molecular weight 486.40 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, trans-N1-[3-[2-[[(3-Chlorophenyl)methyl]amino]-4-pyrimidinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]-1,4-cyclohexanediamine HCl (C22H24ClN9HCl) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 14.0, corresponding to approximately 14 ring(s) or double-bond equivalent(s). With a molecular weight of 486.40 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.
Physical & Chemical Properties
| Molecular Formula | C22H24ClN9 HCl |
| Molecular Weight | 486.40 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) | 14.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1991 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 9 |
Recommended Standards
- 2-(3-Amino-4-methyl-1h-pyrazol-1-yl)propanenitrile (CAS 1344324-00-0)
- 4-(Dimethyl-4h-1,2,4-triazol-3-yl)benzoic acid (CAS 1342135-56-1)
- 2-(Difluoromethyl)-4-methylpyridine-3-acetic acid (CAS 1805280-35-6)
- 2-aminopyridine-3-sulfonamide (CAS 54136-36-6)
- 4-(Cyclopropylmethoxy)-3-(methylamino)phenol (CAS 1243287-41-3)
- (r)-2-([1,1'-biphenyl]-2-yl)-2-aminoethan-1-ol (CAS 1213065-20-3)
- 4-Bromo-3-chlorobenzoic Acid (CAS 25118-59-6)
- (3E)-1-Acetyl-3-[(4-fluorophenyl)methylidene]piperazine-2,5-dione (CAS 155527-25-6)
- (S)-3-(Benzyloxy)butan-1-ol (CAS 90124-16-6)
- Semaglutide impurity 36 (CAS CATO-C4X-222636)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
- Worldwide shipping with full export documentation (HS code guidance available)
- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com