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6265-91-4,MFCD00030229
Catalog No.:AA003ET0

6265-91-4 | 2-(4-Chlorophenyl)benzothiazole

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Purity
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Price(USD)
Quantity
  
200mg
98%
in stock  
$104.00   $73.00
- +
1g
98%
in stock  
$137.00   $96.00
- +
5g
98%
in stock  
$510.00   $357.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003ET0
Chemical Name:
2-(4-Chlorophenyl)benzothiazole
CAS Number:
6265-91-4
Molecular Formula:
C13H8ClNS
Molecular Weight:
245.7273
MDL Number:
MFCD00030229
SMILES:
Clc1ccc(cc1)c1nc2c(s1)cccc2
NSC Number:
33160
Properties
Properties
 
Form:
Solid  
MP:
118℃  

Computed Properties
 
Complexity:
240  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
4.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:DALIANUNIVERSITYOFTECHNOLOGY-CN104910098,2017,BLocationinpatent:Paragraph0036;0037;0038

[2]Dhawale,KiranD.;Ingale,AjitP.;Shinde,SandeepV.;Thorat,NitinM.;Patil,LimbrajR.[SyntheticCommunications,2021,vol.51,#10,p.1588-1601]

[3]Yu,Xiaoqiang;Yin,Qing;Zhang,Zhiheng;Huang,Tianyu;Pu,Zichao;Bao,Ming[TetrahedronLetters,2019,vol.60,#30,p.1964-1966]

[4]Sun,Yadong;Jiang,Huanfeng;Wu,Wanqing;Zeng,Wei;Wu,Xia[OrganicLetters,2013,vol.15,#7,p.1598-1601]

[5]Nale,DeepakB.;Bhanage,BhalchandraM.[Synlett,2015,vol.26,#20,p.2835-2842]

[6]Mettey,Yvette;Michaud,Sabine;Vierfond,JeanMichel[Heterocycles,1994,vol.38,#5,p.1001-1006]

[1]Wen,Xiaoan;Bakali,JamalEl;Deprez-Poulain,Rebecca;Deprez,Benoit[TetrahedronLetters,2012,vol.53,#19,p.2440-2443]

[2]Rambabu;Murthi,P.RadhaKrishna;Dulla,Balakrishna;BasaveswaraRao;Pal,Manojit[SyntheticCommunications,2013,vol.43,#22,p.3083-3092]

[3]Seijas,JulioA.;Vázquez-Tato,M.Pilar;Carballido-Reboredo,M.Raquel;Crecente-Campo,José;Romar-López,Lucía[Synlett,2007,#2,p.313-317]

[4]Chakraborti,AsitK.;Selvam;Kaur,Gurmeet;Bhagat,Srikant[Synlett,2004,#5,p.851-855]

[5]Mourtas,Spyros;Gatos,Dimitrios;Barlos,Kleomenis[TetrahedronLetters,2001,vol.42,#11,p.2201-2204]

[6]Gupta,SayanDutta;Singh,HemendraPratap;Moorthy[SyntheticCommunications,2007,vol.37,#24,p.4327-4329]

[7]Mubeen,Muhammad;Kini,SuvarnaGanesh;Kumar,Avinash;Pai,KarkalaSreedharaRanganath[Lettersindrugdesignanddiscovery,2019,vol.16,#8,p.961-971]

[1]JournalofMedicinalChemistry,2009,vol.52,p.1450-1458

[1]Patent:US2010/190994,2010,A1.Locationinpatent:Page/Pagecolumn19-20

[2]Patent:KR2019/143828,2019,A.Locationinpatent:Paragraph0183-0186

[3]Patent:KR2020/5489,2020,A.Locationinpatent:Paragraph0182;0189-0193

[1]Vodnala,Nagaraju;Gujjarappa,Raghuram;Kabi,ArupK.;Kumar,Mohan;Beifuss,Uwe;Malakar,ChandiC.[Synlett,2018,vol.29,#11,p.1469-1478]

[2]Wu,Xiang-Mei;Shen,Qiu-Xian[LettersinOrganicChemistry,2013,vol.10,#9,p.668-673]

[3]Ranjit,Sadananda;Liu,Xiaogang[Chemistry-AEuropeanJournal,2011,vol.17,#4,p.1105-1108]

[4]Deb,Arghya;Manna,Srimanta;Maji,Arun;Dutta,Uttam;Maiti,Debabrata[EuropeanJournalofOrganicChemistry,2013,#24,p.5251-5256]

[5]Koley,Moumita;Wimmer,Laurin;Schnuerch,Michael;Mihovilovic,MarkoD.[JournalofHeterocyclicChemistry,2013,vol.50,#6,p.1368-1373]

Literature

Title: Synthesis and photophysical properties of yellow-emitting iridium complexes. Effect of the temperature on the character of triplet emission.

Journal: Journal of fluorescence 20121101

Title: Synthesis of novel inhibitors of β-glucuronidase based on benzothiazole skeleton and study of their binding affinity by molecular docking.

Journal: Bioorganic & medicinal chemistry 20110715

Title: Toxicology in the fast lane: application of high-throughput bioassays to detect modulation of key enzymes and receptors.

Journal: Environmental health perspectives 20091201

Title: A basis for reduced chemical library inhibition of firefly luciferase obtained from directed evolution.

Journal: Journal of medicinal chemistry 20090312

Title: 2-(4'-chlorophenyl)benzothiazole is a potent inducer of cytochrome P450IA1 in a human and a mouse cell line. Anomalous correlation between protein and mRNA induction.

Journal: European journal of biochemistry 19890415

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Tags:6265-91-4 Molecular Formula|6265-91-4 MDL|6265-91-4 SMILES|6265-91-4 2-(4-Chlorophenyl)benzothiazole