N-Benzoyl-2'-O-oxan-2-yladenosine

Base Information

Chemical Name:N-Benzoyl-2'-O-oxan-2-yladenosine
CAS No.:31505-87-0
Molecular Formula:C22H25N5O6
Molecular Weight:455.47
Hs Code.:
DSSTox Substance ID:DTXSID70551650
Nikkaji Number:J917.165G
Mol file:31505-87-0.mol

Synonyms:31505-87-0;N-(9-((2R,3R,4R,5R)-4-Hydroxy-5-(hydroxymethyl)-3-((tetrahydro-2H-pyran-2-yl)oxy)tetrahydrofuran-2-yl)-9H-purin-6-yl)benzamide;N-Benzoyl-2'-O-oxan-2-yladenosine;SCHEMBL9353919;DTXSID70551650

Suppliers and Price of N-Benzoyl-2'-O-oxan-2-yladenosine

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 1 raw suppliers

Chemical Property of N-Benzoyl-2'-O-oxan-2-yladenosine

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:455.18048353
Heavy Atom Count:33
Complexity:667

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCOC(C1)OC2C(C(OC2N3C=NC4=C(N=CN=C43)NC(=O)C5=CC=CC=C5)CO)O
Isomeric SMILES:C1CCOC(C1)O[C@@H]2[C@@H]([C@H](O[C@H]2N3C=NC4=C(N=CN=C43)NC(=O)C5=CC=CC=C5)CO)O

Technology Process of N-Benzoyl-2'-O-oxan-2-yladenosine

There total 7 articles about N-Benzoyl-2'-O-oxan-2-yladenosine 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: 80.0%

: 3256-14-2
(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)-4-((tetrahydro-2H-pyran-2-yl)oxy)tetrahydrofuran-3-ol

: 98-88-4
benzoyl chloride

: 31505-87-0
6-N-benzoyl-2'-O-(tetrahyropyran-2-yl)adenosine

Guidance literature:: 1.) pyridine, 0 deg C, 2h, 2.) room temp., 12h;
DOI:10.1021/jo00157a001

Reference yield:

: 110-87-2
3,4-dihydro-2H-pyran

: 31505-87-0
6-N-benzoyl-2'-O-(tetrahyropyran-2-yl)adenosine

Guidance literature:: Multi-step reaction with 3 steps

1: p-toluenesulfonic acid monohydrate / CHCl₃ / 0.25 h

2: pyridine / 5 h

3: triethylamine hydrogen fluoride (TEAHF) / dioxane; tetrahydrofuran / Ambient temperature

With pyridine; toluene-4-sulfonic acid; triethylamine hydrofluoride; In tetrahydrofuran; 1,4-dioxane; chloroform;

Reference yield:

: 69304-45-6
3',5'-O-(1,1,3,3-tetra-isopropyldisiloxane-1,3-diyl)adenosine

: 31505-87-0
6-N-benzoyl-2'-O-(tetrahyropyran-2-yl)adenosine

Guidance literature:: Multi-step reaction with 3 steps

1: p-toluenesulfonic acid monohydrate / CHCl₃ / 0.25 h

2: pyridine / 5 h

3: triethylamine hydrogen fluoride (TEAHF) / dioxane; tetrahydrofuran / Ambient temperature

With pyridine; toluene-4-sulfonic acid; triethylamine hydrofluoride; In tetrahydrofuran; 1,4-dioxane; chloroform;