2,3,4,5-Tetrahydro-7-methoxy-4-methyl-1,4-benzothiazepine

Base Information

• Chemical Name: 2,3,4,5-Tetrahydro-7-methoxy-4-methyl-1,4-benzothiazepine
• CAS No.: 927871-76-9
• Molecular Formula: C₁₁H₁₅NOS
• Molecular Weight: 209.312
• Mol file: 927871-76-9.mol

Synonyms:7-Methoxy-4-methyl-3,5-dihydro-2H-1,4-benzothiazepine;

Chemical Property of 2,3,4,5-Tetrahydro-7-methoxy-4-methyl-1,4-benzothiazepine

Chemical Property:

• Boiling Point: 318.768 °C at 760 mmHg
• PKA: 7.74±0.20(Predicted)
• Flash Point: 146.586 °C
• PSA: 37.77000
• Density: 1.11 g/cm³
• LogP: 2.17060
• Storage Temp.: 2-8°C

Purity/Quality:

99%, ^*data from raw suppliers

2,3,4,5-Tetrahydro-7-methoxy-4-methyl-1,4-benzothiazepine analytical standard ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Uses: It is a benzothiazepine derivative that binds the RyR1 channel and enhances the binding affinity of Calstabin-1. By preventing the depletion of Calstabin-1 from the RyR1 complex, S 107 slows muscle fatique and reduces muscle damage in exercised mice. In a murine model of Duchenne muscular dystrophy, S 107 reduces biochemical and histological evidence of the muscle damage associated with muscular dystrophy, improves muscle function, and increases exercise performance.

Technology Process of 2,3,4,5-Tetrahydro-7-methoxy-4-methyl-1,4-benzothiazepine

There total 7 articles about 2,3,4,5-Tetrahydro-7-methoxy-4-methyl-1,4-benzothiazepine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

7-methoxy-2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine (145903-31-7) + formaldehyd (50-00-0,30525-89-4,61233-19-0) → S107 (927871-76-9)

Guidance literature:

With hydrogenchloride; sodium cyanoborohydride; In methanol; at 20 ℃; for 0.5h; pH=4 - 5;

DOI:10.1021/jm401090a

Reference yield:

7-methoxy-3,4-dihydrobenzo[f][1,4]thiazepin-5(2H)-one (145903-32-8) + formaldehyd (50-00-0,30525-89-4,61233-19-0) → S107 (927871-76-9)

Guidance literature:

7-methoxy-3,4-dihydrobenzo[f][1,4]thiazepin-5(2H)-one; With lithium aluminium tetrahydride; In tetrahydrofuran; diethyl ether; Reflux;

formaldehyd; With sodium cyanoborohydride; In methanol; at 20 ℃;

Reference yield:

6-methoxy-2,3-dihydro-4H-thiochromen-4-one (13735-11-0) → S107 (927871-76-9)

Guidance literature:

Multi-step reaction with 3 steps

1: trifluoroacetic acid; trimethylsilylazide / 48 h / 20 °C

2: lithium aluminium tetrahydride / tetrahydrofuran; diethyl ether / Reflux

3: sodium cyanoborohydride; hydrogenchloride / methanol / 0.5 h / 20 °C / pH 4 - 5

With hydrogenchloride; lithium aluminium tetrahydride; trimethylsilylazide; sodium cyanoborohydride; trifluoroacetic acid; In tetrahydrofuran; methanol; diethyl ether;

DOI:10.1021/jm401090a

upstream raw materials:

6-methoxy-2,3-dihydro-4H-thiochromen-4-one

7-methoxy-3,4-dihydrobenzo[f][1,4]thiazepin-5(2H)-one

7-methoxy-2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine

formaldehyd

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