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588680-36-8,MFCD03423410
Catalog No.:AA00EE15

588680-36-8 | 5-Isopropyl-4-methyl-4h-1,2,4-triazole-3-thiol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$245.00   $172.00
- +
5g
95%
in stock  
$978.00   $685.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EE15
Chemical Name:
5-Isopropyl-4-methyl-4h-1,2,4-triazole-3-thiol
CAS Number:
588680-36-8
Molecular Formula:
C6H11N3S
Molecular Weight:
157.2366
MDL Number:
MFCD03423410
SMILES:
CC(c1nnc(n1C)S)C
Properties
Computed Properties
 
Complexity:
185  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

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
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Tags:588680-36-8 Molecular Formula|588680-36-8 MDL|588680-36-8 SMILES|588680-36-8 5-Isopropyl-4-methyl-4h-1,2,4-triazole-3-thiol
Catalog No.: AA00EE15
588680-36-8,MFCD03423410
588680-36-8 | 5-Isopropyl-4-methyl-4h-1,2,4-triazole-3-thiol
Pack Size： 1g
Purity： 95%
in stock
$245.00 $172.00
Pack Size： 5g
Purity： 95%
in stock
$978.00 $685.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EE15
Chemical Name: 5-Isopropyl-4-methyl-4h-1,2,4-triazole-3-thiol
CAS Number: 588680-36-8
Molecular Formula: C6H11N3S
Molecular Weight: 157.2366
MDL Number: MFCD03423410
SMILES: CC(c1nnc(n1C)S)C
Properties
Complexity: 185  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

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