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Home Amines 51012-31-8
51012-31-8,MFCD00553026
Catalog No.:AA00DIDD

51012-31-8 | 2-(4-Chloro-benzenesulfonylamino)-benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
95%
2 weeks  
$552.00   $386.00
- +
1g
95%
2 weeks  
$582.00   $408.00
- +
5g
95%
2 weeks  
$898.00   $629.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DIDD
Chemical Name:
2-(4-Chloro-benzenesulfonylamino)-benzoic acid
CAS Number:
51012-31-8
Molecular Formula:
C13H10ClNO4S
Molecular Weight:
311.7408
MDL Number:
MFCD00553026
SMILES:
Clc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)O
NSC Number:
626929
Properties
Computed Properties
 
Complexity:
440  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
2.8  

Downstream Synthesis Route

[1]CurrentPatentAssignee:VALOHEALTHINC;VALOEARLYDISCOVERYINC-WO2020/223551,2020,A1Locationinpatent:Paragraph0211;0212

[2]Dychanow;Dychanowa[ZhurnalPrikladnoiKhimii,1959,vol.32,p.924,925;engl.Ausg.S.941]

[3]Ruzi,Rehanguli;Ma,Junyang;Yuan,Xiang-Ai;Wang,Wenliang;Wang,Shanshan;Zhang,Muliang;Dai,Jie;Xie,Jin;Zhu,Chengjian[Chemistry-AEuropeanJournal,2019,vol.25,#55,p.12724-12729]

[4]Li,Jia-Qi;Chen,Cheng;Yao,Min;Sun,Le-Yun;Gao,Han;Chigan,Jiazhu;Yang,Ke-Wu[BioorganicChemistry,2020,vol.105]

[1]Ruzi,Rehanguli;Ma,Junyang;Yuan,Xiang-Ai;Wang,Wenliang;Wang,Shanshan;Zhang,Muliang;Dai,Jie;Xie,Jin;Zhu,Chengjian[Chemistry-AEuropeanJournal,2019,vol.25,#55,p.12724-12729]

Literature

Title: Design and synthesis of small molecule glycerol 3-phosphate acyltransferase inhibitors.

Journal: Journal of medicinal chemistry 20090528

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SDS
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