4-(4-Bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine

Base Information

Chemical Name:4-(4-Bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine
CAS No.:64820-47-9
Molecular Formula:C21H16BrNS
Molecular Weight:394.335
Hs Code.:
DSSTox Substance ID:DTXSID30369531
Nikkaji Number:J2.595.166B
Mol file:64820-47-9.mol

Synonyms:4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine;64820-47-9;HMS664J06;ChemDiv1_027308;DTXSID30369531;DBUUTQFBKDPJHS-UHFFFAOYSA-N;STK754634;AKOS001721050;AJ-091/33279013;SR-01000514689;SR-01000514689-1;2-Phenyl-4-(4-bromophenyl)-2,3-dihydro-1,5-benzothiazepine

Suppliers and Price of 4-(4-Bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine

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-(4-Bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine

Chemical Property:

PSA：37.66000
LogP:6.24260
XLogP3:5.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:393.01868
Heavy Atom Count:24
Complexity:437

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(SC2=CC=CC=C2N=C1C3=CC=C(C=C3)Br)C4=CC=CC=C4

Technology Process of 4-(4-Bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine

There total 5 articles about 4-(4-Bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine 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: 82.0%

: 72758-69-1,2403-27-2,22966-23-0
(E)-1-(4-bromophenyl)-3-phenylprop-2-en-1-one

: 137-07-5
2-amino-benzenethiol

: 64820-47-9
4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine

Guidance literature:: magnesium(II) perchlorate; In 1,2-dichloro-ethane; for 0.666667h; Heating;
DOI:10.1055/s-2007-965892

Reference yield: 76.0%

: 2403-27-2
1-(4-bromophenyl)-3-phenyl-2-propen-1-one

: 137-07-5
2-amino-benzenethiol

: 64820-47-9
4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine

Guidance literature:: In glycerol; at 70 ℃; Green chemistry;
DOI:10.1039/c8nj05611k

Reference yield:

: 40358-31-4
2,3-dihydro-2,4-diphenyl-1,5-benzothiazepine

: 64820-47-9
4-(4-bromophenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine

Guidance literature:: Multi-step reaction with 2 steps

1: methanol / 48 h / Ambient temperature

2: 73 percent / triethylamine / Heating

With triethylamine; In methanol;
DOI:10.1007/BF00842834