3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

Base Information

Chemical Name:3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine
CAS No.:257613-89-1
Molecular Formula:C₃₀H₃₄ClN₉O₅S
Molecular Weight:668.176
Hs Code.:

3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

Synonyms:3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

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Chemical Property of 3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

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Technology Process of 3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

There total 5 articles about 3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine 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: 70.0%

: 257300-86-0
C₃₀H₃₄ClN₉O₄S

: 257613-89-1
3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

Guidance literature:: With sodium periodate; In methanol;
DOI:10.1016/S0960-894X(00)00295-X

Reference yield:

: 4-(2-chloroethyl)sulfinylbenzoic acid

: 17165-10-5
4-amino-N-(5-{[(5-{[(3-amino-3-iminopropyl)amino]carbonyl}-1-methyl-1H-pyrrol-3-yl)amino]carbonyl}-1-methyl-1H-pyrrol-3-yl)-1-methyl-1H-pyrrole-2-carboxamide dihydrochloride

: 257613-89-1
3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

Guidance literature:: 4-(2-chloroethyl)sulfinylbenzoic acid; With dicyclohexyl-carbodiimide; In DMF (N,N-dimethyl-formamide); at 0 ℃; for 0.5h;

4-amino-N-(5-{[(5-{[(3-amino-3-iminopropyl)amino]carbonyl}-1-methyl-1H-pyrrol-3-yl)amino]carbonyl}-1-methyl-1H-pyrrol-3-yl)-1-methyl-1H-pyrrole-2-carboxamide dihydrochloride; With potassium hydrogencarbonate; In DMF (N,N-dimethyl-formamide); at 20 ℃; for 3h;

With hydrogenchloride; In DMF (N,N-dimethyl-formamide); water;

Reference yield:

: 1074-36-8
4-mercaptobenzoic acid

: 257613-89-1
3-[1-methyl-4[1-methyl-4[1-methyl-4[4-(2-chloroethylsulfinyl)phenyl-1-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]pyrrole-2-carboxamido]propionamidine

Guidance literature:: Multi-step reaction with 4 steps

1: 90 percent / NaOH / 25 °C

2: 70 percent / thionyl chloride / toluene

3: DCC; HBT / dimethylformamide

4: 70 percent / aq. NaIO₄ / methanol

With sodium hydroxide; sodium periodate; thionyl chloride; benzotriazol-1-ol; dicyclohexyl-carbodiimide; In methanol; N,N-dimethyl-formamide; toluene; 1: Substitution / 2: Chlorination / 3: Acylation / 4: Oxidation;
DOI:10.1016/S0960-894X(00)00295-X