4-Amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide

Base Information

Chemical Name:4-Amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide
CAS No.:120386-11-0
Molecular Formula:C₁₀H₁₃N₅O₂S
Molecular Weight:267.312
Hs Code.:
DSSTox Substance ID:DTXSID80152834
ChEMBL ID:CHEMBL30286
Mol file:120386-11-0.mol

Synonyms:4-amino-7-((2-hydroxyethoxy)methyl)-7H-pyrrolo(2,3-d)pyrimidine-5-carbothioamide;4-amino-7-((2-hydroxyethoxy)methyl)pyrrolo(2,3-d)pyrimidine-5-thiocarboxamide;compound 229

Suppliers and Price of 4-Amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide

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 2 raw suppliers

Chemical Property of 4-Amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide

Chemical Property:

Vapor Pressure:1.28E-14mmHg at 25°C
Boiling Point:586.9°Cat760mmHg
Flash Point:308.7°C
PSA：148.84000
Density:1.64g/cm³
LogP:0.91600
XLogP3:-1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:267.07899585
Heavy Atom Count:18
Complexity:306

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(C2=C(N=CN=C2N1COCCO)N)C(=S)N

Technology Process of 4-Amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide

There total 5 articles about 4-Amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide 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: 23.0%

: 120386-11-0
4-amino-7-<(2-hydroxyethoxy)methyl>pyrrolo<2,3-d>pyrimidine-5-thiocarboxamide

Guidance literature:

Reference yield: 20.0%

: 120386-10-9
4-amino-7-<(2-hydroxyethoxy)methyl>pyrrolo<2,3-d>pyrimidine-5-formimidate

: 120386-11-0
4-amino-7-<(2-hydroxyethoxy)methyl>pyrrolo<2,3-d>pyrimidine-5-thiocarboxamide

Guidance literature:: With hydrogen sulfide; sodium methylate; for 4h; Ambient temperature;
DOI:10.1021/jm00127a003

Reference yield:

: 19393-83-0
4-amino-6-bromo-5-cyanopyrrolo[2,3-d]pyrimidine

: 120386-11-0
4-amino-7-<(2-hydroxyethoxy)methyl>pyrrolo<2,3-d>pyrimidine-5-thiocarboxamide

Guidance literature:: Multi-step reaction with 4 steps

2: 43 percent / methanolic ammonia / 6 h / 5 °C

3: 23 percent / NaOMe / 3 h / Ambient temperature

4: 20 percent / H₂S, NaOMe / 4 h / Ambient temperature

With hydrogen sulfide; ammonia; sodium methylate;
DOI:10.1021/jm00127a003