N-(8-Benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-5-pyrimidinecarboxamide

Base Information

Chemical Name:N-(8-Benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-5-pyrimidinecarboxamide
CAS No.:84923-06-8
Molecular Formula:C₂₂H₂₈N₄O₂
Molecular Weight:380.49
Hs Code.:
DSSTox Substance ID:DTXSID101005212
Mol file:84923-06-8.mol

Synonyms:BRN 5630976;84923-06-8;N-(8-Benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-5-pyrimidinecarboxamide;5-Pyrimidinecarboxamide, N-(8-benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-;DTXSID101005212;LS-134777;N-(8-Benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2-ethyl-4-methoxypyrimidine-5-carboximidic acid

Suppliers and Price of N-(8-Benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-5-pyrimidinecarboxamide

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
5-PYRIMIDINECARBOXAMIDE, N-(8-BENZYL-3-BETA-NORTROPANYL)-2-ETHYL-4-MET HOXY- 95.00%
5MG
$ 498.91

Total 3 raw suppliers

Chemical Property of N-(8-Benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-5-pyrimidinecarboxamide

Chemical Property:

Vapor Pressure:3.81E-12mmHg at 25°C
Melting Point:133 °C(Solv: isopropyl ether (108-20-3))
Boiling Point:550°C at 760 mmHg
PKA:12.86±0.20(Predicted)
Flash Point:286.4°C
PSA：67.35000
Density:1.21g/cm³
LogP:3.30180
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:380.22122615
Heavy Atom Count:28
Complexity:511

Purity/Quality:: 5-PYRIMIDINECARBOXAMIDE, N-(8-BENZYL-3-BETA-NORTROPANYL)-2-ETHYL-4-MET HOXY- 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC1=NC=C(C(=N1)OC)C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4

Technology Process of N-(8-Benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-5-pyrimidinecarboxamide

There total 4 articles about N-(8-Benzyl-3-beta-nortropanyl)-2-ethyl-4-methoxy-5-pyrimidinecarboxamide 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:

: 542-05-2
acetonedicarboxylic acid

: 84923-06-8
2-Ethyl-4-methoxy-pyrimidine-5-carboxylic acid ((1R,3S,5S)-8-benzyl-8-aza-bicyclo[3.2.1]oct-3-yl)-amide

Guidance literature:: Multi-step reaction with 4 steps

2: NH₂OH*HCl / 0.67 h

3: 80 percent / Na / pentan-1-ol / 80 °C / Heating

4: 1.) NEt₃, ethylchloroformate / 1.) DMF, 2 deg C, 0.5 h; 2.) DMF, 12 h, RT

With hydroxylamine hydrochloride; sodium; chloroformic acid ethyl ester; triethylamine; In pentan-1-ol;

Reference yield:

: 532-24-1
tropinone

: 84923-06-8
2-Ethyl-4-methoxy-pyrimidine-5-carboxylic acid ((1R,3S,5S)-8-benzyl-8-aza-bicyclo[3.2.1]oct-3-yl)-amide

Guidance literature:: Multi-step reaction with 3 steps

1: NH₂OH*HCl / 0.67 h

2: 80 percent / Na / pentan-1-ol / 80 °C / Heating

3: 1.) NEt₃, ethylchloroformate / 1.) DMF, 2 deg C, 0.5 h; 2.) DMF, 12 h, RT

With hydroxylamine hydrochloride; sodium; chloroformic acid ethyl ester; triethylamine; In pentan-1-ol;

Reference yield:

: 1515-26-0
(1R,5S)-8-Methyl-8-aza-bicyclo[3.2.1]octan-3-one oxime

: 84923-06-8
2-Ethyl-4-methoxy-pyrimidine-5-carboxylic acid ((1R,3S,5S)-8-benzyl-8-aza-bicyclo[3.2.1]oct-3-yl)-amide

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / Na / pentan-1-ol / 80 °C / Heating

2: 1.) NEt₃, ethylchloroformate / 1.) DMF, 2 deg C, 0.5 h; 2.) DMF, 12 h, RT

With sodium; chloroformic acid ethyl ester; triethylamine; In pentan-1-ol;