3-methyl-5-phenyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole

Base Information

Chemical Name:3-methyl-5-phenyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole
CAS No.:75671-10-2
Molecular Formula:C₁₉H₂₀N₂
Molecular Weight:276.381
Hs Code.:
DSSTox Substance ID:DTXSID30438312
Nikkaji Number:J1.059.168F
ChEMBL ID:CHEMBL23529

Synonyms:CHEMBL23529;75671-10-2;3-methyl-5-phenyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole;SCHEMBL8503754;DTXSID30438312;BDBM50067809;1,2,3,4,5,6-Hexahydro-3-methyl-5-phenylazepino[4,5-b]indole;3-Methyl-5-phenyl-1,2,3,4,5,6-hexahydro-azepino[4,5-b]indole

Suppliers and Price of 3-methyl-5-phenyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole

Supply Marketing:

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

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Chemical Property of 3-methyl-5-phenyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole

Chemical Property:

XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:276.162648646
Heavy Atom Count:21
Complexity:350

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC2=C(C(C1)C3=CC=CC=C3)NC4=CC=CC=C24

Technology Process of 3-methyl-5-phenyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole

There total 2 articles about 3-methyl-5-phenyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole 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:

: 75671-11-3
5-Phenyl-1,4,5,6-tetrahydro-2H-azepino[4,5-b]indole-3-carboxylic acid ethyl ester

: 75671-10-2
3-methyl-5-phenyl-1,2,3,4,5,6-hexahydroazepino<4,5-b>indole

Guidance literature:: With lithium aluminium tetrahydride; In diethyl ether; for 18h; Yield given; Heating;
DOI:10.1021/jm00185a028

Reference yield:

: 22359-26-8
5-phenyl-1,2,3,4,5,6-hexahydroazepino<4,5-b>indole

: 75671-10-2
3-methyl-5-phenyl-1,2,3,4,5,6-hexahydroazepino<4,5-b>indole

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) 2 M NaOH / 1.) EtOAc

2: LiAlH₄ / diethyl ether / 18 h / Heating

With sodium hydroxide; lithium aluminium tetrahydride; In diethyl ether;
DOI:10.1021/jm00185a028