4-(1-(4-Bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoic acid

Base Information

Chemical Name:4-(1-(4-Bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoic acid
CAS No.:176045-83-3
Molecular Formula:C₂₂H₂₄BrNO₃
Molecular Weight:430.341
Hs Code.:
DSSTox Substance ID:DTXSID201146154
ChEMBL ID:CHEMBL352174

Synonyms:L-761000;CHEMBL352174;D03KSL;SCHEMBL7070915;AXFSURYONUFFTK-UHFFFAOYSA-N;DTXSID201146154;BDBM50289087;1-[(4-Bromophenyl)methyl]-5-methoxy-beta,2-dimethyl-1H-indole-3-butanoic acid;4-(1-(4-Bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoic acid;4-[1-(4-Bromo-benzyl)-5-methoxy-2-methyl-1H-indol-3-yl]-3-methyl-butyric acid;176045-83-3

Suppliers and Price of 4-(1-(4-Bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoic acid

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 4-(1-(4-Bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoic acid

Chemical Property:

XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:429.09396
Heavy Atom Count:27
Complexity:494

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)CC(C)CC(=O)O

Technology Process of 4-(1-(4-Bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoic acid

There total 7 articles about 4-(1-(4-Bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoic 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:

: 185737-64-8
ethyl 4-(1-(4-bromobenzyl)-5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutanoate

: 176045-83-3
L-761,000

Guidance literature:: With sodium hydroxide; In tetrahydrofuran; methanol; for 2h; Yield given; Heating;
DOI:10.1016/0960-894X(96)00101-1

Reference yield:

: 539-88-8
4-oxopentanoic acid ethyl ester

: 176045-83-3
L-761,000

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) HOAc, 2.) HCl / 1.) toluene, room temp., 2.) EtOH, reflux

2: 1.) DIBALH, 2.) tartaric acid / 1.) CH₂Cl₂, toluene, -100 deg C, 2.) MeOH

3: 92 percent / toluene / 80 °C

4: CuI, TMSCl / diethyl ether; tetrahydrofuran / -78 - 20 °C

5: NaOH / methanol; tetrahydrofuran / 2 h / Heating

With hydrogenchloride; sodium hydroxide; copper(l) iodide; chloro-trimethyl-silane; diisobutylaluminium hydride; acetic acid; tartaric acid; In tetrahydrofuran; methanol; diethyl ether; toluene;
DOI:10.1016/0960-894X(96)00101-1

Reference yield:

: 176045-80-0
N-(4-bromobenzyl)-N-(4-methoxyphenyl)-hydrazine

: 176045-83-3
L-761,000

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) HOAc, 2.) HCl / 1.) toluene, room temp., 2.) EtOH, reflux

2: 1.) DIBALH, 2.) tartaric acid / 1.) CH₂Cl₂, toluene, -100 deg C, 2.) MeOH

3: 92 percent / toluene / 80 °C

4: CuI, TMSCl / diethyl ether; tetrahydrofuran / -78 - 20 °C

5: NaOH / methanol; tetrahydrofuran / 2 h / Heating

With hydrogenchloride; sodium hydroxide; copper(l) iodide; chloro-trimethyl-silane; diisobutylaluminium hydride; acetic acid; tartaric acid; In tetrahydrofuran; methanol; diethyl ether; toluene;
DOI:10.1016/0960-894X(96)00101-1