2H-1,4-Benzothiazine-2-carboxylic acid, 3,4-dihydro-2-(((4-(ethoxycarbonyl)phenyl)methyl)amino)-7-methyl-3-oxo-, ethyl ester

Base Information

Chemical Name:2H-1,4-Benzothiazine-2-carboxylic acid, 3,4-dihydro-2-(((4-(ethoxycarbonyl)phenyl)methyl)amino)-7-methyl-3-oxo-, ethyl ester
CAS No.:130832-81-4
Molecular Formula:C22H24N2O5S
Molecular Weight:428.5014
Hs Code.:
DSSTox Substance ID:DTXSID60926934
Nikkaji Number:J522.597C

Synonyms:BRN 4338640;130832-81-4;2H-1,4-Benzothiazine-2-carboxylic acid, 3,4-dihydro-2-(((4-(ethoxycarbonyl)phenyl)methyl)amino)-7-methyl-3-oxo-, ethyl ester;DTXSID60926934;LS-40547;2-[[4-(Ethoxycarbonyl)benzyl]amino]-3,4-dihydro-3-oxo-7-methyl-2H-1,4-benzothiazine-2-carboxylic acid ethyl ester;Ethyl 2-({[4-(ethoxycarbonyl)phenyl]methyl}amino)-3-hydroxy-7-methyl-2H-1,4-benzothiazine-2-carboxylate

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2H-1,4-Benzothiazine-2-carboxylic acid, 3,4-dihydro-2-(((4-(ethoxycarbonyl)phenyl)methyl)amino)-7-methyl-3-oxo-, ethyl ester

Chemical Property:

Vapor Pressure:1.14E-14mmHg at 25°C
Boiling Point:606.8°C at 760 mmHg
Flash Point:320.8°C
Density:1.31g/cm³
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:428.14059304
Heavy Atom Count:30
Complexity:637

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=CC=C(C=C1)CNC2(C(=O)NC3=C(S2)C=C(C=C3)C)C(=O)OCC

Technology Process of 2H-1,4-Benzothiazine-2-carboxylic acid, 3,4-dihydro-2-(((4-(ethoxycarbonyl)phenyl)methyl)amino)-7-methyl-3-oxo-, ethyl ester

There total 2 articles about 2H-1,4-Benzothiazine-2-carboxylic acid, 3,4-dihydro-2-(((4-(ethoxycarbonyl)phenyl)methyl)amino)-7-methyl-3-oxo-, ethyl ester 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: 86.0%

: 366-84-7
ethyl 4-(aminomethyl)benzoate

: 130832-72-3
7-methyl-2-chloro-2-ethoxycarbonyl-2H-1,4-benzothiazin-3(4H)-one

: 130832-81-4
7-methyl-2-<(4-ethoxycarbonylphenyl)methylamino>-2-ethoxycarbonyl-2H-1,4-benzthiazin-3(4H)-one

Guidance literature:: With triethylamine; In benzene; at 20 ℃; for 4h;

Reference yield:

: 72324-44-8
ethyl 2-(p-methylanilido)ethanoate

: 130832-81-4
7-methyl-2-<(4-ethoxycarbonylphenyl)methylamino>-2-ethoxycarbonyl-2H-1,4-benzthiazin-3(4H)-one

Guidance literature:: Multi-step reaction with 2 steps

1: 76 percent / SOCl₂ / 24 h / 20 °C

2: 86 percent / triethylamine / benzene / 4 h / 20 °C

With thionyl chloride; triethylamine; In benzene;