Products 1276666-19-3

CAS 1276666-19-3 appears in our catalog under these names: MK-4305 Impurity 2, Suvorexant Impurity A. Offered by: Chemat Brand. Available pack sizes: on request.

MK-4305 Impurity 2
Chemat Brand
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  • Variants: 1
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Suvorexant Impurity A
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

[(5R)-4-(5-chloro-1,3-benzoxazol-2-yl)-5-methyl-1,4-diazepan-1-yl]-[5-methyl-2-(triazol-2-yl)phenyl]methanone (CAS 1276666-19-3) is a chemical compound with the molecular formula C23H23ClN6O2 and a molecular weight of 450.9 g/mol. IUPAC name: [(5R)-4-(5-chloro-1,3-benzoxazol-2-yl)-5-methyl-1,4-diazepan-1-yl]-[5-methyl-2-(triazol-2-yl)phenyl]methanone. InChIKey: MDEQDBLHVPZJLQ-MRXNPFEDSA-N.

Identity
Molecular formulaC23H23ClN6O2
Molecular weight450.9 g/mol
IUPAC name[(5R)-4-(5-chloro-1,3-benzoxazol-2-yl)-5-methyl-1,4-diazepan-1-yl]-[5-methyl-2-(triazol-2-yl)phenyl]methanone
InChIKeyMDEQDBLHVPZJLQ-MRXNPFEDSA-N
SMILESC[C@@H]1CCN(CCN1C2=NC3=C(O2)C=CC(=C3)Cl)C(=O)C4=C(C=CC(=C4)C)N5N=CC=N5

Computed by PubChem (NCBI)

Synonyms: Suvorexant Impurity A
Isomers (same molecular formula)
[(7S)-4-(5-chloro-1,3-benzoxazol-2-yl)-7-methyl-1,4-diazepan-1-yl]-[5-methyl-2-(triazol-2-yl)phenyl]methanone C23H23ClN6O2
[(7R)-4-(5-chloro-1,3-benzoxazol-2-yl)-7-methyl-1,4-diazepan-1-yl]-[5-methyl-2-(triazol-1-yl)phenyl]methanone C23H23ClN6O2
[(7R)-4-(5-chloro-1,3-benzoxazol-2-yl)-7-methyl-1,4-diazepan-1-yl]-[5-methyl-2-(triazol-2-yl)phenyl]methanone C23H23ClN6O2