GV-224029 free acid

Base Information

Chemical Name:GV-224029 free acid
CAS No.:671207-67-3
Molecular Formula:C₁₉H₁₅ClN₂O₄
Molecular Weight:370.792
Hs Code.:
UNII:70UE3NA02H
Wikidata:Q27265893

Synonyms:GV-224029 free acid;UNII-70UE3NA02H;70UE3NA02H;1H-1-Benzazepine-3-carboxylic acid, 8-chloro-2,3,4,5-tetrahydro-2-oxo-5-(2-oxo-2-(phenylamino)ethylidene)-, (5E)-;671207-67-3;Q27265893

Suppliers and Price of GV-224029 free acid

Supply Marketing:

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

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Chemical Property of GV-224029 free acid

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:370.0720347
Heavy Atom Count:26
Complexity:600

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(C(=O)NC2=C(C1=CC(=O)NC3=CC=CC=C3)C=CC(=C2)Cl)C(=O)O
Isomeric SMILES:C\1C(C(=O)NC2=C(/C1=C/C(=O)NC3=CC=CC=C3)C=CC(=C2)Cl)C(=O)O

Technology Process of GV-224029 free acid

There total 7 articles about GV-224029 free 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: 74.0%

: 274926-28-2
(E)-8-chloro-1-(4-methoxybenzyl)-2-oxo-5-phenylcarbamoylmethylene-2,3,4,5-tetrahydro-1H-benzo[b]azepine-3-carboxylic acid tert-butyl ester

: 671207-67-3
(E)-8-chloro-2-oxo-5-phenylcarbamoylmethylene-1,2,3,4-tetrahydro-1H-benzo[b]azepine-3-carboxylic acid

Guidance literature:: With sulfuric acid; methoxybenzene; trifluoroacetic acid; at 80 ℃; for 1h;
DOI:10.1016/S0014-827X(03)00166-6

Reference yield:

: 6828-35-9
5-chloro-2-iodoaniline

: 671207-67-3
(E)-8-chloro-2-oxo-5-phenylcarbamoylmethylene-1,2,3,4-tetrahydro-1H-benzo[b]azepine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 7 steps

1.1: 66 percent / NaI / dimethylformamide / 2 h / 80 °C

2.1: 97 percent / pyridine / toluene / 0.75 h / 0 °C

3.1: 92 percent / aq. LiOH / tetrahydrofuran / 18 h / 20 °C

4.1: 65 percent / 4-(dimethylamino)pyridine; 1-[3-(dimethylamino)propyl]-3-ethylcarbodiimide*HCl / CH₂Cl₂ / 1.25 h / 0 - 20 °C

5.1: [(CH₃)3Si]2NNa / tetrahydrofuran / 1 h / 0 °C

5.2: 80 percent / tetrahydrofuran / 1 h / 0 °C

6.1: 93 percent / Et₃N / Pd(PPh₃)4 / acetonitrile / 2 h / Heating

7.1: 74 percent / CF₃COOH; H₂SO₄; anisole / 1 h / 80 °C

With pyridine; dmap; lithium hydroxide; sulfuric acid; sodium hexamethyldisilazane; methoxybenzene; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; trifluoroacetic acid; sodium iodide; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; dichloromethane; N,N-dimethyl-formamide; toluene; acetonitrile;
DOI:10.1016/S0014-827X(03)00166-6

Reference yield:

: 274926-23-7
(5-chloro-2-iodo-phenyl)-(4-methoxybenzyl)-amine

: 671207-67-3
(E)-8-chloro-2-oxo-5-phenylcarbamoylmethylene-1,2,3,4-tetrahydro-1H-benzo[b]azepine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 6 steps

1.1: 97 percent / pyridine / toluene / 0.75 h / 0 °C

2.1: 92 percent / aq. LiOH / tetrahydrofuran / 18 h / 20 °C

3.1: 65 percent / 4-(dimethylamino)pyridine; 1-[3-(dimethylamino)propyl]-3-ethylcarbodiimide*HCl / CH₂Cl₂ / 1.25 h / 0 - 20 °C

4.1: [(CH₃)3Si]2NNa / tetrahydrofuran / 1 h / 0 °C

4.2: 80 percent / tetrahydrofuran / 1 h / 0 °C

5.1: 93 percent / Et₃N / Pd(PPh₃)4 / acetonitrile / 2 h / Heating

6.1: 74 percent / CF₃COOH; H₂SO₄; anisole / 1 h / 80 °C

With pyridine; dmap; lithium hydroxide; sulfuric acid; sodium hexamethyldisilazane; methoxybenzene; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; trifluoroacetic acid; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; dichloromethane; toluene; acetonitrile;
DOI:10.1016/S0014-827X(03)00166-6