7-((5-Methyl-1,2,4-oxadiazol-3-yl)methyl)theophylline

Base Information

Chemical Name:7-((5-Methyl-1,2,4-oxadiazol-3-yl)methyl)theophylline
CAS No.:88338-63-0
Molecular Formula:C₁₁H₁₂N₆O₃
Molecular Weight:276.255
Hs Code.:
UNII:YDA5V2F8HR
DSSTox Substance ID:DTXSID90236972
Nikkaji Number:J552.025H
Wikidata:Q83119055
ChEMBL ID:CHEMBL4303231
Mol file:88338-63-0.mol

Synonyms:3-(theophyllin-7-ylmethyl)-5-methyl-1,2,4-oxadiazole;CHINOIN 170;CHINOIN-170

Suppliers and Price of 7-((5-Methyl-1,2,4-oxadiazol-3-yl)methyl)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
Packaging
price

American Custom Chemicals Corporation
3,7-DIHYDRO-1,3-DIMETHYL-7-((5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL)-1H-PURINE-2,6-DIONE 95.00%
5MG
$ 505.62

Total 1 raw suppliers

Chemical Property of 7-((5-Methyl-1,2,4-oxadiazol-3-yl)methyl)theophylline

Chemical Property:

Vapor Pressure:2.69E-12mmHg at 25°C
Refractive Index:1.7000 (estimate)
Boiling Point:553.5°C at 760 mmHg
Flash Point:288.6°C
PSA：100.74000
Density:1.63g/cm³
LogP:-0.82660
XLogP3:-0.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:276.09708827
Heavy Atom Count:20
Complexity:432

Purity/Quality:

99% ^*data from raw suppliers

3,7-DIHYDRO-1,3-DIMETHYL-7-((5-METHYL-1,2,4-OXADIAZOL-3-YL)METHYL)-1H-PURINE-2,6-DIONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NC(=NO1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Technology Process of 7-((5-Methyl-1,2,4-oxadiazol-3-yl)methyl)theophylline

There total 3 articles about 7-((5-Methyl-1,2,4-oxadiazol-3-yl)methyl)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: 94.0%