111974-73-3

Basic information

• Product Name: Phenyl2-(Phenylthio)Phenylcarbamate
• Synonyms: Phenyl2-(Phenylthio)Phenylcarbamate;Quetiapine Related CoMpound (Phenyl-2-(phenyl thio)phenyl carbaMide)
• CAS NO: 111974-73-3
• Molecular Formula: C19H15NO2S
• Molecular Weight: 321.3929
• Mol File: 111974-73-3.mol
• Article Data: 9

Chemical Properties

• Boiling Point: 438°C at 760 mmHg
• Flash Point: 218.7°C
• Appearance: /
• Density: 1.28g/cm³
• Vapor Pressure: 7.14E-08mmHg at 25°C
• Refractive Index: 1.675
• Storage Temp.: -20°C
• Solubility: Chloroform (Slightly), Methanol (Slightly)
• PKA: 12.41±0.70(Predicted)
• CAS DataBase Reference: Phenyl2-(Phenylthio)Phenylcarbamate(CAS DataBase Reference)
• NIST Chemistry Reference: Phenyl2-(Phenylthio)Phenylcarbamate(111974-73-3)
• EPA Substance Registry System: Phenyl2-(Phenylthio)Phenylcarbamate(111974-73-3)

Safety Data

• Hazardous Substances Data: 111974-73-3(Hazardous Substances Data)

Usage

Uses

Different sources of media describe the Uses of 111974-73-3 differently. You can refer to the following data:
1. Phenyl[2-phenylthio)phenyl]carbamate is an intermediate utilized for the synthesis of Quetiapine Hemifumarate (Q510000), an atypical antipsychotic agent used for the treatment of patients with schizop hrenia, biopolar disorder and to treat major depressive disorder.
2. Phenyl[2-phenylthio)phenyl]carbamate is an intermediate utilized for the synthesis of Quetiapine Hemifumarate (Q510000), an atypical antipsychotic agent used for the treatment of patients with schizophrenia, biopolar disorder and to treat major depressive disorder.

InChI:InChI=1/C19H15NO2S/c21-19(22-15-9-3-1-4-10-15)20-17-13-7-8-14-18(17)23-16-11-5-2-6-12-16/h1-14H,(H,20,21)

Upstream product

• 1134-94-7 2-phenylsulfanyl-aniline 
• 1885-14-9 phenyl chloroformate 
• 108-98-5 thiophenol 
• 88-73-3 2-Chloronitrobenzene 
• 4171-83-9 2-nitrophenyl phenyl sulfide 
• 137-07-5 2-amino-benzenethiol 
• 591-50-4 iodobenzene 
• 1527-12-4 2-(phenylthio)benzoic acid 
• 108-95-2 phenol 
• 882-33-7 diphenyldisulfane 
• 14178-42-8 2-benzamidopyridine 1-oxide 

Downstream Products

• 1345730-60-0 11-(benzylamino)dibenzo[b,f][1,4]thiazepine 
• 13745-86-3 11-chloro-dibenzo[b,f][1,4]thiazepine 
• 5747-48-8 11-(1-piperazinyl)dibenzo[b,f][1,4]thiazepine 
• 111974-69-7 Quetiapine 
• 13739-55-4 2-phenylthiophenyl isocyanate 

Relevant articles and documents

INFLUENZA VIRUS REPLICATION INHIBITOR AND USE THEREOF

Disclosed are a compound as shown in formula (I) as an influenza virus replication inhibitor and a preparation method therefor, a pharmaceutical composition comprising the compound and the use of the compound and pharmaceutical composition thereof in the treatment of influenza.

Design, synthesis and anticancer activity of N-(1-(4-(dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl)-1-oxo-3-phenylpropan-2-yl derivatives

Novel N-(1-(4-(dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl)-1-oxo-3-phenylpropan-2-yl derivatives were designed, synthesized and their chemical structures were confirmed by 1H NMR, 13C NMR and Mass spectra. The anticancer activities of the newly synthesized compounds were evaluated in vitro against three human cancer cell lines including K562, Colo-205 and MDA-MB 231 by MTT assay. The screening results showed that five compounds (16b, 16d, 16i, 16p and 16q) exhibited potent cytotoxic activities with IC50 values between 20 and 40 μM. Further in vitro studies revealed that inhibition of sirtuins could be the possible mechanism of action of these molecules.

Synthesis, characterization and antimicrobial activity of 2-(11-oxodibenzo [b,f][1,4]thiazepin-10(11H)-yl)-N (substituted phenyl) acetamide derivatives

Substituted dibenzo [b,f][1,4]thiazepines analogues carrying 2-chloro N-phenylacetamide moiety attached to 11-C position have been synthesized and evaluated using IR, 1H NMR and mass spectra. Antibacterial properties have been examined for the synthesized derivatives against gram positive and gram negative bacteria. 2-(11-Oxodibenzo [b,f][1,4]thiazepin-10(11H)-yl)-N phenylacetamide derivatives show good significant antimicrobial activity.