1-(3,4-Dichlorophenyl)-2-[4-[(1-ethylpiperidin-3-yl)amino]-6-methylpyrimidin-2-yl]guanidine

Base Information

Chemical Name:1-(3,4-Dichlorophenyl)-2-[4-[(1-ethylpiperidin-3-yl)amino]-6-methylpyrimidin-2-yl]guanidine
CAS No.:21062-28-2
Molecular Formula:C19H25 Cl2 N7
Molecular Weight:422.36
Hs Code.:
DSSTox Substance ID:DTXSID501030736
Nikkaji Number:J78.486I
Mol file:21062-28-2.mol

Synonyms:1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpiperidin-3-yl)amino]-6-methylpyrimidin-2-yl]guanidine;WR-81844;21062-28-2 (racemic);DTXSID501030736;(+/-)-2-[3-(3,4-Dichlorophenyl)guanidino]-4-(1-ethyl-3-piperidylamino)-6-methylpyrimidine;1-(3,4-Dichlorophenyl)-2-{4-[(1-ethyl-3-piperidinyl)amino]-6-methyl-2-pyrimidinyl}guanidine

Suppliers and Price of 1-(3,4-Dichlorophenyl)-2-[4-[(1-ethylpiperidin-3-yl)amino]-6-methylpyrimidin-2-yl]guanidine

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 4 raw suppliers

Chemical Property of 1-(3,4-Dichlorophenyl)-2-[4-[(1-ethylpiperidin-3-yl)amino]-6-methylpyrimidin-2-yl]guanidine

Chemical Property:

Vapor Pressure:8.31E-15mmHg at 25°C
Refractive Index:1.6300 (estimate)
Boiling Point:609.7°Cat760mmHg
PKA:8.80±0.10(Predicted)
Flash Point:322.5°C
PSA：88.96000
Density:1.4g/cm³
LogP:4.70340
XLogP3:3.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:421.1548492
Heavy Atom Count:28
Complexity:521

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN1CCCC(C1)NC2=NC(=NC(=C2)C)N=C(N)NC3=CC(=C(C=C3)Cl)Cl

Technology Process of 1-(3,4-Dichlorophenyl)-2-[4-[(1-ethylpiperidin-3-yl)amino]-6-methylpyrimidin-2-yl]guanidine

There total 4 articles about 1-(3,4-Dichlorophenyl)-2-[4-[(1-ethylpiperidin-3-yl)amino]-6-methylpyrimidin-2-yl]guanidine 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: 40.0%

: (±)-2-[3-(3,4-dichlorophenyl)guanidino]-6-methyl-4-(3-piperidylamino)pyrimidine trifluoroacetate

: 75-07-0,9002-91-9
acetaldehyde

: 21062-28-2
(±)-2-[3-(3,4-dichlorophenyl)guanidino]-4-(1-ethyl-3-piperidylamino)-6-methylpyrimidine

Guidance literature:: With sodium tris(acetoxy)borohydride; In dichloromethane; at 20 ℃; for 1.5h;

Reference yield:

: 2-[3-(3,4-dichlorophenyl)guanidino]-6-methyl-4-pyrimidinol

: 21062-28-2
(±)-2-[3-(3,4-dichlorophenyl)guanidino]-4-(1-ethyl-3-piperidylamino)-6-methylpyrimidine

Guidance literature:: Multi-step reaction with 4 steps

1: trichlorophosphate / 4.75 h / 0 - 90 °C / Inert atmosphere

2: N-ethyl-N,N-diisopropylamine / N,N-dimethyl acetamide / 18 h / 90 °C / Inert atmosphere

3: dichloromethane / 20 °C

4: sodium tris(acetoxy)borohydride / dichloromethane / 1.5 h / 20 °C

With sodium tris(acetoxy)borohydride; N-ethyl-N,N-diisopropylamine; trichlorophosphate; In dichloromethane; N,N-dimethyl acetamide;

Reference yield:

: 51387-79-2
3-(4-Chloro-6-methyl-2-pyrimidinyl)-1-(3,4-dichlorophenyl)guanidine

: 21062-28-2
(±)-2-[3-(3,4-dichlorophenyl)guanidino]-4-(1-ethyl-3-piperidylamino)-6-methylpyrimidine

Guidance literature:: Multi-step reaction with 3 steps

1: N-ethyl-N,N-diisopropylamine / N,N-dimethyl acetamide / 18 h / 90 °C / Inert atmosphere

2: dichloromethane / 20 °C

3: sodium tris(acetoxy)borohydride / dichloromethane / 1.5 h / 20 °C

With sodium tris(acetoxy)borohydride; N-ethyl-N,N-diisopropylamine; In dichloromethane; N,N-dimethyl acetamide;