4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid

Base Information

Chemical Name:4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid
CAS No.:943739-84-2
Molecular Formula:C₃₈H₄₅N₅O₈
Molecular Weight:699.804
Hs Code.:

Synonyms:4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid

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Chemical Property of 4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid

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Technology Process of 4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid

There total 6 articles about 4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid 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: 97.0%

: 943739-82-0
4-{4-[(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-(3-nitrobenzylcarbamoyl)methyl]phenoxy}3-butyric acid benzyl ester

: 943739-84-2
4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid

Guidance literature:: With hydrogen; palladium 10% on activated carbon; In methanol; for 3h;

Reference yield:

: 943739-77-3
4-(4-boronophenoxy)butyric acid

: 943739-84-2
4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid

Guidance literature:: Multi-step reaction with 4 steps

1: potassium carbonate / N,N-dimethyl-formamide / 8 h / 60 °C

2: 1,2-dichloro-ethane / 100 °C / Microwave irradiation

3: N-ethyl-N,N-diisopropylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole / N,N-dimethyl-formamide; dichloromethane / 20 °C

4: palladium 10% on activated carbon; hydrogen / methanol / 3 h / 2844.39 Torr

With 1-hydroxy-7-aza-benzotriazole; palladium 10% on activated carbon; hydrogen; potassium carbonate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In methanol; dichloromethane; 1,2-dichloro-ethane; N,N-dimethyl-formamide;
DOI:10.1021/acs.jmedchem.5b00788

Reference yield:

: 943739-78-4
4-(3-benzyloxycarbonylpropoxy)phenylboronic acid

: 943739-84-2
4-{4-[(3-amino-benzylcarbamoyl)-(1-di-tert-butoxycarbonylaminoisoquinolin-6-ylamino)-methyl]-phenoxy}-butyric acid

Guidance literature:: Multi-step reaction with 3 steps

1: 1,2-dichloro-ethane / 100 °C / Microwave irradiation

2: N-ethyl-N,N-diisopropylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole / N,N-dimethyl-formamide; dichloromethane / 20 °C

3: palladium 10% on activated carbon; hydrogen / methanol / 3 h / 2844.39 Torr

With 1-hydroxy-7-aza-benzotriazole; palladium 10% on activated carbon; hydrogen; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In methanol; dichloromethane; 1,2-dichloro-ethane; N,N-dimethyl-formamide;
DOI:10.1021/acs.jmedchem.5b00788