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13029-72-6,MFCD01104937
Catalog No.:AA000U5G

13029-72-6 | 2-(4-Chlorophenylsulfonamido)acetic acid

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500mg
97%
1 week  
$167.00   $117.00
- +
1g
97%
1 week  
$218.00   $153.00
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5g
>97%
1 week  
$623.00   $436.00
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10g
>97%
1 week  
$990.00   $693.00
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25g
>97%
1 week  
$1,846.00   $1,293.00
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50g
>97%
1 week  
$3,274.00   $2,292.00
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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:
AA000U5G
Chemical Name:
2-(4-Chlorophenylsulfonamido)acetic acid
CAS Number:
13029-72-6
Molecular Formula:
C8H8ClNO4S
Molecular Weight:
249.6714
MDL Number:
MFCD01104937
SMILES:
OC(=O)CNS(=O)(=O)c1ccc(cc1)Cl
Properties
Computed Properties
 
Complexity:
316  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
1.1  

Downstream Synthesis Route

[1]Nikolenko[ZhurnalObshcheiKhimii,1956,vol.26,p.806;engl.Ausg.S.921]

[1]Inagaki;Miwa;Yashiro;Okuda[ChemicalandPharmaceuticalBulletin,1982,vol.30,#9,p.3244-3254]

[1]DeRuiter;Brubaker;Garner;Barksdale;Mayfield[JournalofPharmaceuticalSciences,1987,vol.76,#2,p.149-152]

[2]Inagaki;Miwa;Yashiro;Okuda[ChemicalandPharmaceuticalBulletin,1982,vol.30,#9,p.3244-3254]

[3]Scozzafava,Andrea;Supuran,ClaudiuT.[EuropeanJournalofMedicinalChemistry,2000,vol.35,#3,p.299-307]

[4]Jain,Priti;Wadhwa,PankajK.;Gunapati,Sinduri;Jadhav,HemantR.[BioorganicandMedicinalChemistry,2016,vol.24,#11,p.2567-2575]

[5]Kumar,Devendra;Gupta,SukeshK.;Ganeshpurkar,Ankit;Gutti,Gopichand;Krishnamurthy,Sairam;Modi,Gyan;Singh,SushilK.[EuropeanJournalofMedicinalChemistry,2018,vol.150,p.87-101]

[1]Nagasawa;Elberling;Goon;Shirota[JournalofMedicinalChemistry,1994,vol.37,#24,p.4222-4226]

[1]Nagasawa;Elberling;Goon;Shirota[JournalofMedicinalChemistry,1994,vol.37,#24,p.4222-4226]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
Tags:13029-72-6 Molecular Formula|13029-72-6 MDL|13029-72-6 SMILES|13029-72-6 2-(4-Chlorophenylsulfonamido)acetic acid