CAS 109010-60-8: (S)-1,1-Dimethylethyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benz[b]azepin-1-acetate

Description: (S)-1,1-Dimethylethyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benz[b]azepin-1-acetate, with CAS number 109010-60-8, is a chemical compound characterized by its complex bicyclic structure, which includes a benzazepine core. This compound features a dimethyl group that contributes to its steric properties, and an amino group that may participate in hydrogen bonding and influence its reactivity. The presence of an acetate moiety suggests potential for esterification reactions and may affect its solubility and biological activity. As a tetrahydro derivative, it possesses a saturated ring system, which can enhance stability and reduce reactivity compared to unsaturated analogs. The stereochemistry indicated by the (S) configuration implies specific spatial arrangements that can significantly impact the compound's pharmacological properties, including receptor binding and metabolic pathways. Overall, this compound may exhibit interesting biological activities, making it a subject of interest in medicinal chemistry and drug development.

Formula: C₁₆H₂₂N₂O₃

InChI: InChI=1S/C16H22N2O3/c1-16(2,3)21-14(19)10-18-13-7-5-4-6-11(13)8-9-12(17)15(18)20/h4-7,12H,8-10,17H2,1-3H3/t12-/m0/s1

InChI key: InChIKey=QTEDVVHLTMELTB-LBPRGKRZSA-N

SMILES: O=C(OC(C)(C)C)CN1C(=O)C(N)CCC=2C=CC=CC21

Synonyms:

• (S)-1,1-Dimethylethyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benz[b]azepin-1-acetate
• (S)-1-[(tert-Butyloxycarbonyl)methyl]-3-amino-2,3,4,5-tetrahydro-1H-[1]benzazepin-2-one
• (S)-3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benazepine-1-acetic acid 1,1-dimethyl ethyl ester
• (S)-tert-butyl-2-(3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetate
• 1H-1-Benzazepine-1-acetic acid, 3-amino-2,3,4,5-tetrahydro-2-oxo-, 1,1-dimethylethyl ester, (3S)-
• 1H-1-Benzazepine-1-acetic acid, 3-amino-2,3,4,5-tetrahydro-2-oxo-, 1,1-dimethylethyl ester, (S)-
• BNZ
• T-butyl,3S-amino-2,3,4,5-tetrahydro-1H-[1]-benazepin-2-one-1-acetate
• tert-Butyl-3-amino-2,3,4,5-tetrahydro-2-oxo-1H-(3S)-benzazepine-1-acetate
• tert-butyl [(3S)-3-amino-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetate
• T-butyl,3S-amino-2,3,4,5-tetrahydro-1H-[1]benaepin-2-one-1acetate

Benazepril Related Compound F (tert-Butyl-3-amino-2,3,4,5-tetrahydro-2-oxo-1H-1-(3S)-benzazepine-1-acetic acid)

CAS: 109010-60-8

Lactams not elsewhere specified or included

• Formula: C₁₆H₂₂N₂O₃
• Color and Shape: White Off-White Crystalline Powder
• Molecular weight: 290.16304

(S)-tert-Butyl 2-(3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetate

CAS: 109010-60-8

• Formula: C₁₆H₂₂N₂O₃
• Purity: 97%
• Color and Shape: Solid
• Molecular weight: 290.3575

tert-Butyl (S)-2-(3-Amino-2-oxo-2,3,4,5-tetrahydrobenzo[b]azepin-1-yl)acetate

CAS: 109010-60-8

• Purity: 99%
• Molecular weight: 290.36g/mol

1,1-Dimethylethyl [(3S)-3-Amino-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetate

CAS: 109010-60-8

• Formula: C₁₆H₂₂N₂O₃
• Color and Shape: Neat
• Molecular weight: 290.36

Benazepril Related Compound F

CAS: 109010-60-8

• Formula: C₁₆H₂₂N₂O₃
• Molecular weight: 290.37

(S)-tert-Butyl 2-(3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetate

CAS: 109010-60-8

• Purity: 95.0%
• Color and Shape: Solid
• Molecular weight: 290.3630065917969

tert-Butyl-(S)-(3-amino-2-oxo-2,3,4,5-tetrahydrobenzo[b]azepin-1-yl) Acetate

CAS: 109010-60-8

• Formula: C₁₆H₂₂N₂O₃
• Color and Shape: Neat
• Molecular weight: 290.36

tert-Butyl-(S)-(3-amino-2-oxo-2,3,4,5-tetrahydrobenzo[b]azepin-1-yl) acetate

CAS: 109010-60-8

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• Formula: C₁₆H₂₂N₂O₃
• Purity: Min. 95%
• Molecular weight: 290.36 g/mol