4-(Allylamino)-2-((2-chlorobenzyl)thio)-6-phenylpyrimidine-5-carbonitrile CAS 303985-72-0
| CAS No. | 303985-72-0 |
| Molecular Formula | C21H17ClN4S |
| Molecular Weight | 392.90 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 4-(Allylamino)-2-((2-chlorobenzyl)thio)-6-phenylpyrimidine-5-carbonitrile (C21H17ClN4S) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
4-(Allylamino)-2-((2-chlorobenzyl)thio)-6-phenylpyrimidine-5-carbonitrile (CAS 303985-72-0) is a high-purity analytical reference standard with the molecular formula C21H17ClN4S and a molecular weight of 392.90 g/mol.
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), 4-(Allylamino)-2-((2-chlorobenzyl)thio)-6-phenylpyrimidine-5-carbonitrile 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 | C21H17ClN4S |
| Molecular Weight | 392.90 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, 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) | 15.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 1 |
Related Allylamino Standards
- Ethyl 5-(2-(2-(allylamino)-2-oxoacetyl)-1H-pyrrol-1-yl)-1-phenyl-1H-pyrazole-4-carboxylate (CAS 477709-22-1)
- 4-(Allylamino)-2-((4-methylbenzyl)thio)-6-phenylpyrimidine-5-carbonitrile (CAS 320422-40-0)
- 4-(Allylamino)-2-(benzylthio)-6-(p-tolyl)pyrimidine-5-carbonitrile (CAS 303985-61-7)
- 2-(2-(Allylamino)-4-oxo-4,5-dihydrothiazol-5-yl)-N-(4-bromophenyl)acetamide (CAS 898646-00-9)
- Methyl 3-(2-((2-(2-(allylamino)acetamido)phenyl)thio)acetamido)thiophene-2-carboxylate (CAS 866017-59-6)
- 4-(Allylamino)-2-((2,6-dichlorobenzyl)thio)-6-phenylpyrimidine-5-carbonitrile (CAS 303985-77-5)
- 5-(Allylamino)-2-(5-((4-chlorophenoxy)methyl)furan-2-yl)oxazole-4-carbonitrile (CAS 931749-05-2)
- 5-(Allylamino)-2-(5-((4-methoxyphenoxy)methyl)furan-2-yl)oxazole-4-carbonitrile (CAS 946201-00-9)
Recommended Standards
- 3-Benzyl-2-(((4-chlorophenyl)thio)methyl)quinazolin-4(3H)-one (CAS 866010-89-1)
- 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidin-4-ol (CAS 860609-65-0)
- 2-Chloro-4-methanesulfonyl-N-[4-(piperidin-1-yl)phenyl]benzamide (CAS 860609-10-5)
- Ethyl 6-benzyl-2-[(chloroacetyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate (CAS 846600-29-1)
- Ethyl 3-(5-cyano-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-1H-indole-2-carboxylate (CAS 339099-08-0)
- 1-[4-(6-Chloro-2-methyl-pyrimidin-4-yl)-piperidin-1-yl]-2,2-dimethyl-propan-1-one (CAS 1316217-82-9)
- 1-(2-Hydroxy-4-methoxyphenyl)-2-(4-methoxyphenyl)ethan-1-one (CAS 39604-64-3)
- 2-Propylthiazole (CAS 17626-75-4)
- 6-Chloro-5-fluoro-4-iodopyridin-3-amine (CAS 1312755-62-6)
- 4-Chloro-2-((o-tolylamino)methyl)phenol (CAS 1021059-42-6)
- 1-(2,2-Diethoxyethyl)-4-ethyl-3,5-dimethyl-1H-pyrazole (CAS 1255147-11-5)
- Sertraline Hydrochloride EP Impurity D (CAS CATO-C4X-13444)
- N-Ethyl-N-(4-methyloxazol-2-yl)acetamide (CAS 57067-93-3)
- Pancreatic Polypeptide (human) trifluoroacetate salt (CAS 75976-10-2)
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