4-benzhydryl-N-phenylpiperazine-1-carbothioamide

Base Information

Chemical Name:4-benzhydryl-N-phenylpiperazine-1-carbothioamide
CAS No.:6936-30-7
Molecular Formula:C24H25N3S
Molecular Weight:387.5404
Hs Code.:2933599090
NSC Number:67862
DSSTox Substance ID:DTXSID20360411
ChEMBL ID:CHEMBL2158903
Mol file:6936-30-7.mol

Synonyms:6936-30-7;4-benzhydryl-N-phenylpiperazine-1-carbothioamide;4-(diphenylmethyl)-N-phenylpiperazine-1-carbothioamide;CHEMBL2158903;NSC67862;(4-(DIPHENYLMETHYL)PIPERAZINYL)(PHENYLAMINO)METHANE-1-THIONE;CBMicro_029708;NCIOpen2_008380;Oprea1_648641;SCHEMBL15919865;DTXSID20360411;BDBM50393669;MFCD01541812;NSC-67862;STK031086;AKOS000586816;MS-9088;BIM-0029744.P001;Z45794824

Suppliers and Price of 4-benzhydryl-N-phenylpiperazine-1-carbothioamide

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

American Custom Chemicals Corporation
(4-(DIPHENYLMETHYL)PIPERAZINYL)(PHENYLAMINO)METHANE-1-THIONE 95.00%
5MG
$ 498.33

Total 4 raw suppliers

Chemical Property of 4-benzhydryl-N-phenylpiperazine-1-carbothioamide

Chemical Property:

Vapor Pressure:2.54E-10mmHg at 25°C
Boiling Point:504.9°Cat760mmHg
PKA:14.08±0.20(Predicted)
Flash Point:259.2°C
PSA：50.60000
Density:1.221g/cm³
LogP:4.73940
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:387.17691898
Heavy Atom Count:28
Complexity:452

Purity/Quality:: (4-(DIPHENYLMETHYL)PIPERAZINYL)(PHENYLAMINO)METHANE-1-THIONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC4=CC=CC=C4

Technology Process of 4-benzhydryl-N-phenylpiperazine-1-carbothioamide

There total 3 articles about 4-benzhydryl-N-phenylpiperazine-1-carbothioamide 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:

: 841-77-0
diphenylmethylpiperazine

: 103-72-0
phenyl isothiocyanate

: 6936-30-7
4-benzhydryl-N-phenylpiperazine-1-carbothioamide

Guidance literature:: With methanol; at 20 ℃;
DOI:10.1021/jm3006004

Reference yield:

: 62-53-3
aniline

: 6936-30-7
4-benzhydryl-N-phenylpiperazine-1-carbothioamide

Guidance literature:: Multi-step reaction with 2 steps

1.1: triethylamine / 0.5 h / 20 °C

1.2: 0.33 h / 5 - 20 °C

2.1: methanol / 20 °C

With methanol; triethylamine;
DOI:10.1021/jm3006004