Ivabradine Impurity 16

cas: 304464-98-0 — see every product listed under this CAS number, including other names

Ivabradine Impurity 16 (CAS 304464-98-0) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULI3063
cas304464-98-0
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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Structural formula: {0} (CAS {1})

3-[3-[[(7S)-3-hydroxy-4-methoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one (CAS 304464-98-0) is a chemical compound with the molecular formula C26H34N2O5 and a molecular weight of 454.6 g/mol. IUPAC name: 3-[3-[[(7S)-3-hydroxy-4-methoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one. InChIKey: CKPWHHKAGYLHEU-HXUWFJFHSA-N.

Identity
Molecular formulaC26H34N2O5
Molecular weight454.6 g/mol
IUPAC name3-[3-[[(7S)-3-hydroxy-4-methoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one
InChIKeyCKPWHHKAGYLHEU-HXUWFJFHSA-N
SMILESCN(CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)C[C@H]3CC4=CC(=C(C=C34)OC)O

Computed by PubChem (NCBI)

Synonyms: Ivabradine Impurity 16, Ivabradine hydrochloride impurity III, 3-Hydroxy Ivabradine, Ivabradine USP Rc 3-Desmethyl Ivabradine
Related forms of this compound
3-[3-[(3-hydroxy-4-methoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one C26H34N2O5
Isomers (same molecular formula)
3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-8-hydroxy-7-methoxy-2,5-dihydro-1H-3-benzazepin-4-one C26H34N2O5
3-[3-[[(7S)-4-hydroxy-3-methoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one C26H34N2O5
3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7-hydroxy-8-methoxy-2,5-dihydro-1H-3-benzazepin-4-one C26H34N2O5
3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one C26H34N2O5

Also listed as

Ivabradine USP RC 3-Desmethyl Ivabradine Chemat Brand CAS 304464-98-0
3-Hydroxy Ivabradine TRC CAS 304464-98-0