3-[1-(3-Aminopropyl)-1H-indol-3-YL]-4-(1-methyl-1H-indol-3-YL)-1H-pyrrole-2,5-dione

Base Information

Chemical Name:3-[1-(3-Aminopropyl)-1H-indol-3-YL]-4-(1-methyl-1H-indol-3-YL)-1H-pyrrole-2,5-dione
CAS No.:125313-65-7
Molecular Formula:C₂₄H₂₂N₄O₂
Molecular Weight:398.464
Hs Code.:
UNII:Y6197FQK8I
DSSTox Substance ID:DTXSID00154734
Nikkaji Number:J468.437K
Wikidata:Q27093045
Pharos Ligand ID:GU16GJAMNAUW
Metabolomics Workbench ID:146561
ChEMBL ID:CHEMBL269264
Mol file:125313-65-7.mol

Synonyms:Bis VIII;bisindolylmaleimide VIII;Ro 31-7549;Ro-31-7549

Suppliers and Price of 3-[1-(3-Aminopropyl)-1H-indol-3-YL]-4-(1-methyl-1H-indol-3-YL)-1H-pyrrole-2,5-dione

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
Bisindolylmaleimide VIII acetate
1mg
$ 286.00

Sigma-Aldrich
Ro-31-7549, Monohydrate - CAS 125313-65-7 - CalbiochemA cell permeable, reversible, selective protein kinase C (PKC) inhibitor (IC = 158 nM for rat brain PKC) that acts at the ATP binding site of PKC.
1mg
$ 161.87

Total 8 raw suppliers

Chemical Property of 3-[1-(3-Aminopropyl)-1H-indol-3-YL]-4-(1-methyl-1H-indol-3-YL)-1H-pyrrole-2,5-dione

Chemical Property:

Vapor Pressure:4.7E-19mmHg at 25°C
Boiling Point:693 °C at 760 mmHg
Flash Point:372.9 °C
PSA：119.35000
Density:1.36 g/cm³
LogP:4.16900
Storage Temp.:−20°C
Solubility.:DMSO: soluble
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:398.17427596
Heavy Atom Count:30
Complexity:735

Purity/Quality:

98%min ^*data from raw suppliers

Bisindolylmaleimide VIII acetate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)CCCN
Uses It is a potent inhibitor of protein kinase C (PKC) activity.

Technology Process of 3-[1-(3-Aminopropyl)-1H-indol-3-YL]-4-(1-methyl-1H-indol-3-YL)-1H-pyrrole-2,5-dione

There total 8 articles about 3-[1-(3-Aminopropyl)-1H-indol-3-YL]-4-(1-methyl-1H-indol-3-YL)-1H-pyrrole-2,5-dione 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:

: BIM-azide

: 125313-65-7
3-[1-(3-aminopropyl)indole-3-yl]-4-(1-methylindole-3-yl)-1H-pyrrole-2,5-dione

Guidance literature:: palladium-carbon; In ethyl acetate;

Reference yield:

: Trifluoro-methanesulfonic acid 3-{3-[4-(1-methyl-1H-indol-3-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]-indol-1-yl}-propyl ester

: 125313-65-7
3-[1-(3-aminopropyl)indole-3-yl]-4-(1-methylindole-3-yl)-1H-pyrrole-2,5-dione

Guidance literature:: With ammonium hydroxide; In dichloromethane; Ambient temperature;
DOI:10.1021/jm00084a004

Reference yield:

: 120-72-9
indole

: 125313-65-7
3-[1-(3-aminopropyl)indole-3-yl]-4-(1-methylindole-3-yl)-1H-pyrrole-2,5-dione

Guidance literature:: Multi-step reaction with 6 steps

1: 1.) NaH / 1.) DMF, 0.5 h, 2.) DMF, RT, 18 h

2: CH₂Cl₂ / 3 h / Ambient temperature

3: Et₃N / CH₂Cl₂ / 18 h / Ambient temperature

4: 94 percent / 33percent aq. ammonia / dimethylformamide / 4 h / 140 °C

5: 2,6-lutidine / CH₂Cl₂ / 2 h / 0 °C

6: 33percent aq. ammonia / CH₂Cl₂ / Ambient temperature

With 2,6-dimethylpyridine; ammonium hydroxide; sodium hydride; triethylamine; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm00084a004