(7-Chlorothiazolo[5,4-d]pyrimidin-2-yl)phenylamine

Base Information

• Chemical Name: (7-Chlorothiazolo[5,4-d]pyrimidin-2-yl)phenylamine
• CAS No.: 871266-78-3
• Molecular Formula: C11H7 Cl N4 S
• Molecular Weight: 262.722
• ChEMBL ID: CHEMBL3088335
• DSSTox Substance ID: DTXSID10467529
• Nikkaji Number: J2.262.640J
• Wikidata: Q82294505
• Mol file: 871266-78-3.mol

Synonyms:871266-78-3;(7-Chlorothiazolo[5,4-d]pyrimidin-2-yl)phenylamine;7-Chloro-N-phenylthiazolo[5,4-d]pyrimidin-2-amine;CHEMBL3088335;7-CHLORO-N-PHENYL-[1,3]THIAZOLO[5,4-D]PYRIMIDIN-2-AMINE;SCHEMBL5108536;DTXSID10467529;BDBM50189178;7-Chloro-N-phenyl[1,3]thiazolo[5,4-d]pyrimidin-2-amine

Chemical Property of (7-Chlorothiazolo[5,4-d]pyrimidin-2-yl)phenylamine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.771
• Boiling Point: 424.668°C at 760 mmHg
• Flash Point: 210.632°C
• PSA: 78.94000
• Density: 1.539g/cm³
• LogP: 3.55630
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 262.0079951
• Heavy Atom Count: 17
• Complexity: 262

Purity/Quality:

97% ^*data from raw suppliers

(7-CHLOROTHIAZOLO[5,4-D]PYRIMIDIN-2-YL)PHENYLAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC2=NC3=C(S2)N=CN=C3Cl

Technology Process of (7-Chlorothiazolo[5,4-d]pyrimidin-2-yl)phenylamine

There total 2 articles about (7-Chlorothiazolo[5,4-d]pyrimidin-2-yl)phenylamine 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: 96.0%

5-amino-4,6-dichloropyridimine (5413-85-4) + phenyl isothiocyanate (103-72-0) → (7-chloro[1,3]thiazolo[5,4-d]pyrimidin-2-yl)(phenyl)amine (871266-78-3)

Guidance literature:

With potassium fluoride on basic alumina; In acetonitrile; at 60 ℃; for 5h; Reagent/catalyst; Solvent; Temperature; Time;

DOI:10.1016/j.ejmech.2013.10.039

Reference yield:

→ (7-chloro[1,3]thiazolo[5,4-d]pyrimidin-2-yl)(phenyl)amine (871266-78-3)

Guidance literature:

Reference yield: 98.0%

(7-chloro[1,3]thiazolo[5,4-d]pyrimidin-2-yl)(phenyl)amine (871266-78-3) + diethylamine (109-89-7) → 2-phenylamino-7-diethylaminothiazolo[5,4-d]pyrimidine

Guidance literature:

In methanol; at 20 ℃;

DOI:10.1016/j.ejmech.2013.10.039

upstream raw materials:

5-amino-4,6-dichloropyridimine

phenyl isothiocyanate

Downstream raw materials:

N²-phenyl-N⁷-(3,4,5-trimethoxybenzyl)[1,3]thiazolo[5,4-d]pyrimidine-2,7-diamine

N⁷-(4-methoxyphenyl)-N²-phenyl[1,3]thiazolo[5,4-d]pyrimidine-2,7-diamine

N²,N⁷-diphenyl[1,3]thiazolo[5,4-d]pyrimidine-2,7-diamine

N⁷-(3-chlorophenyl)-N²-phenyl[1,3]thiazolo[5,4-d]pyrimidine-2,7-diamine

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