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83123-75-5,MFCD00962150
Catalog No.:AA0059LM

83123-75-5 | 2-((5-Thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)ethyl acetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$41.00   $29.00
- +
5g
97%
in stock  
$68.00   $48.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0059LM
Chemical Name:
2-((5-Thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)ethyl acetate
CAS Number:
83123-75-5
Molecular Formula:
C6H8N2O2S3
Molecular Weight:
236.3349
MDL Number:
MFCD00962150
SMILES:
CCOC(=O)CSc1n[nH]c(=S)s1
Properties
Properties
 
Form:
Solid  

Computed Properties
 
Complexity:
254  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
2.1  

Downstream Synthesis Route

[1]Zheng-Hua,Zhu;Shu-Ling,Chen;Zu-Guang,Yao[OrganicPreparationsandProceduresInternational,1991,vol.23,#5,p.679-682]

[1]Zheng-Hua,Zhu;Shu-Ling,Chen;Zu-Guang,Yao[OrganicPreparationsandProceduresInternational,1991,vol.23,#5,p.679-682]

79558-02-4    83123-75-5   
ethyl5-3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio-1,3,4-thiadiazol-2-ylthioacetate 

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US4855310,1989,A

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US4855310,1989,A

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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Tags:83123-75-5 Molecular Formula|83123-75-5 MDL|83123-75-5 SMILES|83123-75-5 2-((5-Thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)ethyl acetate
Catalog No.: AA0059LM
83123-75-5,MFCD00962150
83123-75-5 | 2-((5-Thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)ethyl acetate
Pack Size： 1g
Purity： 97%
in stock
$41.00 $29.00
Pack Size： 5g
Purity： 97%
in stock
$68.00 $48.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA0059LM
Chemical Name: 2-((5-Thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)ethyl acetate
CAS Number: 83123-75-5
Molecular Formula: C6H8N2O2S3
Molecular Weight: 236.3349
MDL Number: MFCD00962150
SMILES: CCOC(=O)CSc1n[nH]c(=S)s1
Properties
Form: Solid  
Complexity: 254  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 5  
XLogP3: 2.1  
Downstream Synthesis Route
2491-38-5    83123-75-5    137618-45-2 

[1]Zheng-Hua,Zhu;Shu-Ling,Chen;Zu-Guang,Yao[OrganicPreparationsandProceduresInternational,1991,vol.23,#5,p.679-682]

83123-75-5    137618-46-3 

[1]Zheng-Hua,Zhu;Shu-Ling,Chen;Zu-Guang,Yao[OrganicPreparationsandProceduresInternational,1991,vol.23,#5,p.679-682]

79558-02-4    83123-75-5   
ethyl5-3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio-1,3,4-thiadiazol-2-ylthioacetate 

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US4855310,1989,A

105-36-2    1072-71-5    83123-75-5 

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US4855310,1989,A

Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

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