38338-23-7

Basic information

• Product Name: 6-NITRO-2-PHENYLBENZOTHIAZOLE
• Synonyms: 6-NITRO-2-PHENYLBENZOTHIAZOLE;2-phenyl-6-nitrobenzothiazole
• CAS NO: 38338-23-7
• Molecular Formula: C₁₃H₈N₂O₂S
• Molecular Weight: 256.28
• Product Categories: pharmacetical
• Mol File: 38338-23-7.mol
• Article Data: 24

Chemical Properties

• Boiling Point: 440.4 °C at 760mmHg
• Flash Point: 220.2 °C
• Appearance: /
• Density: 1.397 g/cm³
• Vapor Pressure: 1.52E-07mmHg at 25°C
• Refractive Index: 1.71
• CAS DataBase Reference: 6-NITRO-2-PHENYLBENZOTHIAZOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 6-NITRO-2-PHENYLBENZOTHIAZOLE(38338-23-7)
• EPA Substance Registry System: 6-NITRO-2-PHENYLBENZOTHIAZOLE(38338-23-7)

Safety Data

• Hazardous Substances Data: 38338-23-7(Hazardous Substances Data)

Usage

General Description

6-Nitro-2-phenylbenzothiazole is a chemical compound with the molecular formula C13H8N2OS. It is a benzothiazole derivative with a nitro group at the 6-position and a phenyl group at the 2-position. 6-NITRO-2-PHENYLBENZOTHIAZOLE is used as a fluorescent probe for measuring pH in biological systems. It is also known to exhibit antitumor activity and has potential applications in the field of medicinal chemistry. Additionally, 6-Nitro-2-phenylbenzothiazole has been studied for its photophysical properties, making it a promising candidate for use in various optical and imaging applications. Overall, this compound has several potential uses in the fields of biotechnology, pharmaceuticals, and materials science.

InChI:InChI=1/C13H8N2O2S/c16-15(17)10-6-7-11-12(8-10)18-13(14-11)9-4-2-1-3-5-9/h1-8H

Upstream product

• 883-93-2 2-Phenylbenzothiazole 
• 23451-98-1 2-amino-5-nitrobenzenethiol 
• 98-88-4 benzoyl chloride 
• 3393-96-2 p-nitrobenzanilide 
• 7664-93-9 sulfuric acid 
• 100-01-6 4-nitro-aniline 
• 2942-06-5 6-nitrobenzo[d]thiazole 
• 65-85-0 benzoic acid 
• 95-16-9 1,3-Benzothiazole 
• 6293-83-0 2-iodo-4-nitrophenylamine 
• 108-88-3 toluene 
• 108-86-1 bromobenzene 
• 100-46-9 benzylamine 
• 98-91-9 thiobenzoic acid 

Downstream Products

• 6392-97-8 2-phenylbenzo[d]thiazole-6-amine 
• 1426262-55-6 C₂₈H₃₄N₄OS₂ 
• 1426262-52-3 C₂₈H₃₂N₄O₂S₂ 
• 1426262-48-7 C₁₅H₁₁ClN₂OS 

Relevant articles and documents

Fluorophotometric method for the determination of nitrate with 2-phenylbenzothiazole

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Design, synthesis and biological evaluation of new benzoxazolone/benzothiazolone derivatives as multi-target agents against Alzheimer's disease

In this study, four series of compounds with benzoxazolone and benzothiazolone cores were designed, synthesized and evaluated as multifunctional agents against Alzheimer's disease (AD). Additionally, in order to shed light on the effect of the carbonyl groups of benzoxazolone/benzothiazolone, benzoxazole/benzothiazole-containing analogues were also synthesized and evaluated. Inhibition potency of all final compounds towards cholinesterase enzymes and their antioxidant activity were tested. Subsequently, the anti-inflammatory activity, cytotoxicity, apoptosis, and Aβ aggregation inhibition tests were also performed for selected compounds. The results indicated that compounds 11c, a pentanamide derivative with benzothiazolone core, and 14b, a keton derivative with benzothiazolone core, were considered as promising multi-functional agents for further investigation against AD. The reversibility, kinetic and molecular docking studies were also performed for the compounds with the highest AChE 14b (eeAChE IC50 = 0.34 μM, huAChE IC50 = 0.46 μM) and BChE 11c (eqBChE IC50 = 2.98 μM, huBChE IC50 = 2.56 μM) inhibitory activities.

Preparation method of substituted benzothiazole C2 arylated derivative

The invention discloses a substituted benzothiazole C2 arylated derivative and a preparation method thereof. The preparation method comprises the following steps: mixing substituted benzothiazole represented by a formula (II) and substituted benzaldehyde represented by a formula (III); adding a free radical initiator N-chlorosuccinimide (NCS) and an oxidant tert-butyl hydroperoxide (TBHP), carrying out a stirring reaction for about 12 h at 120 DEG C in a nitrogen atmosphere by using DMSO as a solvent, and after the reaction is finished, separating and purifying the reaction liquid to prepare the substituted benzothiazole C2 arylated derivative represented by a formula (I). The invention provides a new method for synthesizing a benzothiazole C2 arylated derivative by taking an NCS/TBHP double component as an oxidation system through a stirring and reaction for about 12 hours at 120 DEG C in a nitrogen atmosphere under the assistance of a strong Lewis base DMSO; and according to the method, an NCS/TBHP double-component oxidation system and an aprotic solvent are selected, and the method has the advantages of being simple in catalytic system, good in product yield and wide in substrate range.