850879-09-3

Basic information

• Product Name: N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide
• Synonyms: N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide;1-Piperazinecarbothioamide, N-(1,3-benzodioxol-5-ylmethyl)-4-benzofuro(3,2-D)pyrimidin-4-yl-;Mp470;AMuvatinib;HPK 56;MP-470(MP 470);AMuvatinib (MP-470);AMuvatinib (MP-470, HPK 56)
• CAS NO: 850879-09-3
• Molecular Formula: C23H21N5O3S
• Molecular Weight: 447.51
• Product Categories: Inhibitor;Inhibitors
• Mol File: 850879-09-3.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 649.5 °C at 760 mmHg
• Flash Point: 346.6 °C
• Appearance: /
• Density: 1.443
• Solubility: ≥22.4 mg/mL in DMSO; insoluble in H2O; insoluble in EtOH
• CAS DataBase Reference: N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide(CAS DataBase Reference)
• NIST Chemistry Reference: N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide(850879-09-3)
• EPA Substance Registry System: N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide(850879-09-3)

Safety Data

• Hazardous Substances Data: 850879-09-3(Hazardous Substances Data)

Usage

Description

N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide is a complex organic compound with a unique chemical structure that features a benzodioxole moiety, a benzofuro[3,2-d]pyrimidine core, and a piperazinecarbothioamide group. N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide is characterized by its potential biological activity and may have applications in various fields, particularly in the pharmaceutical industry.

Uses

Used in Pharmaceutical Industry:
N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide is used as a potential therapeutic agent for targeting specific biological pathways and receptors. Its unique structure allows it to interact with cellular targets, making it a candidate for the development of new drugs to treat various diseases.
Used in Medicinal Chemistry Research:
In the field of medicinal chemistry, this compound serves as a valuable research tool for understanding the structure-activity relationships of biologically active molecules. Its synthesis and modification can provide insights into the design of more effective and selective drugs.
Used in Drug Discovery:
N-(1,3-Benzodioxol-5-ylmethyl)-4-benzofuro[3,2-d]pyrimidin-4-yl-1-piperazinecarbothioamide is used in drug discovery processes to identify novel lead compounds with potential therapeutic applications. Its unique chemical features can be exploited to develop new drugs with improved efficacy and safety profiles.

InChI:InChI=1S/C23H21N5O3S/c32-23(24-12-15-5-6-18-19(11-15)30-14-29-18)28-9-7-27(8-10-28)22-21-20(25-13-26-22)16-3-1-2-4-17(16)31-21/h1-6,11,13H,7-10,12,14H2,(H,24,32)

Upstream product

• 380339-27-5 · 4-(Piperazin-1-yl)benzo[4,5]furo[3,2-d]pyrimidine 
• 1015482-56-0 N-benzo[1,3]dioxol-5-ylmethyl-thioformamide chloride 

Relevant articles and documents

PROTEIN KINASE INHIBITORS

Protein kinase inhibitors are disclosed having utility in the treatment of protein kinase-mediated diseases and conditions, such as cancer. The compounds of this invention have the following structure (I) including steroisomers, prodrugs and pharmaceutica