7-(3-(N-Ethylnicotinamidomethyl)-2-hydroxypropyl)theophylline

Base Information

Chemical Name:7-(3-(N-Ethylnicotinamidomethyl)-2-hydroxypropyl)theophylline
CAS No.:69517-63-1
Molecular Formula:C₁₈H₂₂N₆O₄
Molecular Weight:386.41
Hs Code.:
DSSTox Substance ID:DTXSID50989477
Nikkaji Number:J130.191H
Mol file:69517-63-1.mol

Synonyms:69517-63-1;BRN 1187400;7-(3-(N-Ethylnicotinamidomethyl)-2-hydroxypropyl)theophylline;7-Theophyllineethanol, alpha-(N-ethylnicotinamidomethyl)-;Purineethanol, 1,3-dimethyl-2,6-dioxo-alpha-(N-ethylnicotinamidomethyl)-;DTXSID50989477;C18H22N6O4;LS-149540;alpha-(N-Ethylnicotinamidomethyl)-7-theophyllineethanol;3-Pyridinecarboxamide, N-ethyl-N-[2-hydroxy-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)propyl]-;N-(3-(1,3-Dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-2-hydroxypropyl)-N-ethylnicotinamide;N-[3-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-2-hydroxypropyl]-N-ethylpyridine-3-carboxamide;N-[3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2-hydroxypropyl]-N-ethylpyridine-3-carboxamide

Suppliers and Price of 7-(3-(N-Ethylnicotinamidomethyl)-2-hydroxypropyl)theophylline

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
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price

Total 1 raw suppliers

Chemical Property of 7-(3-(N-Ethylnicotinamidomethyl)-2-hydroxypropyl)theophylline

Chemical Property:

Vapor Pressure:3.46E-20mmHg at 25°C
Boiling Point:693.5°Cat760mmHg
Flash Point:373.2°C
PSA：115.25000
Density:1.4g/cm³
LogP:-0.64810
XLogP3:-0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:386.17025320
Heavy Atom Count:28
Complexity:617

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN(CC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)O)C(=O)C3=CN=CC=C3

Technology Process of 7-(3-(N-Ethylnicotinamidomethyl)-2-hydroxypropyl)theophylline

There total 1 articles about 7-(3-(N-Ethylnicotinamidomethyl)-2-hydroxypropyl)theophylline 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: