11-[1-(3,5-dihydro-2H-pyrazin-4-yl)-1-hydroxyethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Base Information

Chemical Name:11-[1-(3,5-dihydro-2H-pyrazin-4-yl)-1-hydroxyethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
CAS No.:63257-31-8
Molecular Formula:C18H19N5O2
Molecular Weight:337.381
Hs Code.:2933990090
DSSTox Substance ID:DTXSID40979302

Synonyms:11-[1-(3,5-dihydro-2H-pyrazin-4-yl)-1-hydroxyethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one;DTXSID40979302;6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-(1-piperazinylacetyl)-;11-[1-(3,6-Dihydropyrazin-1(2H)-yl)-1-hydroxyethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-ol

Suppliers and Price of 11-[1-(3,5-dihydro-2H-pyrazin-4-yl)-1-hydroxyethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

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

TRC
N-DesmethylPirenzepine
1mg
$ 165.00

TRC
N-DesmethylPirenzepine
10mg
$ 1320.00

Medical Isotopes, Inc.
N-Desmethylpirenzepine
5 mg
$ 990.00

Biosynth Carbosynth
N-Desmethyl pirenzepine
10 mg
$ 1638.00

Biosynth Carbosynth
N-Desmethyl pirenzepine
2 mg
$ 495.50

Biosynth Carbosynth
N-Desmethyl pirenzepine
1 mg
$ 272.60

Biosynth Carbosynth
N-Desmethyl pirenzepine
5 mg
$ 900.90

American Custom Chemicals Corporation
N-DESMETHYL PIRENZEPINE 95.00%
10MG
$ 1963.50

American Custom Chemicals Corporation
N-DESMETHYL PIRENZEPINE 95.00%
1MG
$ 750.75

Total 4 raw suppliers

Chemical Property of 11-[1-(3,5-dihydro-2H-pyrazin-4-yl)-1-hydroxyethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Chemical Property:

Vapor Pressure:2.95E-12mmHg at 25°C
Boiling Point:496.7°Cat760mmHg
PKA:11.29±0.20(Predicted)
Flash Point:254.2°C
PSA：83.02000
Density:1.38g/cm³
LogP:1.25210
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:337.15387487
Heavy Atom Count:25
Complexity:542

Purity/Quality:

95% ^*data from raw suppliers

N-DesmethylPirenzepine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(N1CCN=CC1)(N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4)O
Uses A metabolite of Pirenzepine A metabolite of Pirenzepine.

Technology Process of 11-[1-(3,5-dihydro-2H-pyrazin-4-yl)-1-hydroxyethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

There total 4 articles about 11-[1-(3,5-dihydro-2H-pyrazin-4-yl)-1-hydroxyethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one 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: 16.0%

: 110-85-0
piperazine

: 28797-48-0
11-(chloroacetyl)-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one

: 63257-31-8,122859-63-6
N-Demethyl-Pirenzepin

Guidance literature:: With potassium carbonate; In acetonitrile; for 0.5h; Reflux;
DOI:10.1016/j.ejmech.2020.112623

Reference yield:

: 885-70-1
5H-benzo[e]pyrido[3,2-b][1,4]diazepin-6(11H)-one

: 63257-31-8,122859-63-6
N-Demethyl-Pirenzepin

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / dioxane / 5 h / Heating

2: dioxane / 1 h / Heating

With triethylamine; In 1,4-dioxane;
DOI:10.1021/jm00111a032

Reference yield:

: 29868-97-1,93173-05-8
pirenzepine dihydrochloride

: 63257-31-8,122859-63-6
N-Demethyl-Pirenzepin

Guidance literature:: With hydrogenchloride; carbonochloridic acid 1-chloro-ethyl ester; N-ethyl-N,N-diisopropylamine; Yield given. Multistep reaction; 1.) chloroform, reflux, 1 h, 2.) methanol, reflux, 3 h;
DOI:10.1021/jm00111a032