Trenizine

Base Information

Chemical Name:Trenizine
CAS No.:82190-93-0
Molecular Formula:C₃₁H₄₀N₂O
Molecular Weight:456.671
Hs Code.:
UNII:1WPQ720NCK
DSSTox Substance ID:DTXSID60868648
Wikidata:Q27253001
NCI Thesaurus Code:C66622
ChEMBL ID:CHEMBL2104897
Mol file:82190-93-0.mol

Synonyms:Trenizine;Trenizine [INN];82190-93-0;UNII-1WPQ720NCK;1WPQ720NCK;4-(4-benzhydrylpiperazin-1-yl)-1-(4-tert-butylphenyl)butan-1-ol;(+-)-alpha-(p-tert-Butylphenyl)-4-(diphenylmethyl)-1-piperazinebutanol;CHEMBL2104897;DTXSID60868648;Q27253001;1-(4-TERT-BUTYLPHENYL)-4-[4-(DIPHENYLMETHYL)PIPERAZIN-1-YL]BUTAN-1-OL

Suppliers and Price of Trenizine

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

Total 3 raw suppliers

Chemical Property of Trenizine

Chemical Property:

Vapor Pressure:9.76E-15mmHg at 25°C
Boiling Point:589.4°C at 760 mmHg
Flash Point:277.2°C
PSA：26.71000
Density:1.069g/cm³
LogP:6.08070
XLogP3:6.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:456.314063904
Heavy Atom Count:34
Complexity:541

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O
Uses Trenizine is used as an antibacterial agent against Staphylococcus aureus.

Technology Process of Trenizine

There total 4 articles about Trenizine 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: 79.0%

: 89223-70-1
4-(4-benzhydrylpiperazin-1-yl)-1-(4-(tert-butyl)phenyl)butan-1-one

: 82190-93-0,89224-07-7
4-(4-benzhydrylpiperazin-1-yl)-1-(4-(tert-butyl)phenyl)-butan-1-ol

Guidance literature:: With sodium tetrahydroborate; In methanol; at 20 ℃; for 3h;
DOI:10.1021/jm5010682

Reference yield:

: 90-99-3
diphenylchloromethane

: 82190-93-0,89224-07-7
4-(4-benzhydrylpiperazin-1-yl)-1-(4-(tert-butyl)phenyl)-butan-1-ol

Guidance literature:: Multi-step reaction with 3 steps

1: acetonitrile / 18 h / 70 °C

2: sodium hydrogencarbonate / water; butanone / 16 h / 85 °C

3: sodium tetrahydroborate / methanol / 3 h / 20 °C

With sodium tetrahydroborate; sodium hydrogencarbonate; In methanol; water; acetonitrile; butanone;
DOI:10.1021/jm5010682

Reference yield:

: 91-01-0
1,1-Diphenylmethanol

: 82190-93-0,89224-07-7
4-(4-benzhydrylpiperazin-1-yl)-1-(4-(tert-butyl)phenyl)-butan-1-ol

Guidance literature:: Multi-step reaction with 4 steps

1: thionyl chloride / dichloromethane / 4.5 h / 20 °C

2: acetonitrile / 18 h / 70 °C

3: sodium hydrogencarbonate / water; butanone / 16 h / 85 °C

4: sodium tetrahydroborate / methanol / 3 h / 20 °C

With sodium tetrahydroborate; thionyl chloride; sodium hydrogencarbonate; In methanol; dichloromethane; water; acetonitrile; butanone;
DOI:10.1021/jm5010682