(S)-1-(4-Chlorophenyl)-7-isopropoxy-6-methoxy-2-(4-(methyl(((1r,4S)-4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl)methyl)amino)phenyl)-1,4-dihydroisoquinolin-3(2H)-one CAS 1313363-54-0
| CAS No. | 1313363-54-0 |
| Molecular Formula | C38H47ClN4O4 |
| Molecular Weight | 659.26 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
(S)-1-(4-Chlorophenyl)-7-isopropoxy-6-methoxy-2-(4-(methyl(((1r,4S)-4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl)methyl)amino)phenyl)-1,4-dihydroisoquinolin-3(2H)-one (CAS 1313363-54-0) is a high-purity analytical reference standard with the molecular formula C38H47ClN4O4 and a molecular weight of 659.26 g/mol.
Structurally, (S)-1-(4-Chlorophenyl)-7-isopropoxy-6-methoxy-2-(4-(methyl(((1r,4S)-4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl)methyl)amino)phenyl)-1,4-dihydroisoquinolin-3(2H)-one (C38H47ClN4O4) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, 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 659.26 g/mol, it falls into the high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
CATO manufactures (S)-1-(4-Chlorophenyl)-7-isopropoxy-6-methoxy-2-(4-(methyl(((1r,4S)-4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl)methyl)amino)phenyl)-1,4-dihydroisoquinolin-3(2H)-one 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.
Physical & Chemical Properties
| Molecular Formula | C38H47ClN4O4 |
| Molecular Weight | 659.26 g/mol |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 17.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 4 |
Related S Standards
- rel-1-(4-Chlorophenyl)-7-isopropoxy-6-methoxy-2-(4-(methyl(((1r,4r)-4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl)methyl)amino)phenyl)-1,4-dihydroisoquinolin-3(2H)-one (CAS 1313363-86-8)
- 2,2'-Bis(2-chlorophenyl)-4,4',5,5'-tetraphenyl-1,1'-biimidazole (CAS 1707-68-2)
- 2-(2-Chlorophenyl)-4,5-diphenylimidazole-1,2＇-dimer (CAS 7189-82-4)
- 4-Chlorophenyl-2,3,4,6-tetra-O-acetyl-b-D-glucopyranoside (CAS 5041-92-9)
- N-[(3-Chlorophenyl)methyl]-N-(2-{N-[(3-chlorophenyl)methyl]4-methoxybenzenesulfonamido}ethyl)-4-methoxybenzene-1-sulfonamide (CAS 338775-09-0)
- 1-(2-Chlorophenyl)pyrrolidine-2,5-dione (CAS 7402-22-4)
- (E)-1-(4-chlorophenyl)-2-phenyl-4-(p-tolylthio)-6,7-dihydro-1H-indole-5-carbaldehyde O-(2,3-dichlorobenzoyl) oxime (CAS 478033-28-2)
- (2S)-3-{4-[(2-chlorophenyl)diphenylmethoxy]phenyl}-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid (CAS 350241-80-4)
Recommended Standards
- (S)-2-(tert-Butoxy)-2-(7-(4-chlorophenyl)-5-methyl-2-(1-methyl-3-(1-(oxetan-3-yl)piperidin-4-yl)-1H-indazol-5-yl)benzo[d]thiazol-6-yl)acetic acid (CAS 2219362-41-9)
- (S)-tert-Butyl 3-([[(9H-fluoren-9-yl)methoxy]carbonyl]amino)-4-[[3-(4-chlorobenzoyl)-4,5-dimethylthien-2-yl]amino]-4-oxobutanoate (CAS 1268524-65-7)
- Avatrombopag Impurity 45 (CAS CATO-C4X-223445)
- [P,P'-1,3-Bis(di-i-propylphosphino)propane][P-1,3-bis(di-i-propylphosphino)propane]palladium(0) (CAS 123333-45-9)
- 4-(3-Chloro-1-benzothiophen-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile (CAS 477886-59-2)
- 2,3-Dichloro-N,N-dimethylbenzenesulfonamide (CAS 865664-00-2)
- tert-Butyl (R)-2-(2-hydroxyethyl)piperazine-1-carboxylate hydrochloride (CAS 2103402-66-8)
- 9-Chloro-9-phenyl-9H-fluorene (CAS 25022-99-5)
- Ethyl 4,7-dibromoquinoline-3-carboxylate (CAS 2180727-08-4)
- 4-Amino-1-[3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one (CAS 701937-51-1)
- Bis(3,5,3’,5’-dimethoxydibenzylideneacetone)palladium(0) (CAS 811862-77-8)
- 3-Bromo-4-methylbenzoic Acid (CAS 7697-26-9)
- (±)-O-Desmethylnaproxen-d3 (α-methyl-d3) (CAS 1122399-99-8)
- D-Ile17-Tirzepatide (CAS CATO-CPTD788917)
Why CATO?
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