Home Other Building Blocks 2-Mercapto-1,3,4-thiadiazole

2-Mercapto-1,3,4-thiadiazole

CAS No.:
18686-82-3
Catalog Number:
AG003HHZ
Molecular Formula:
C2H2N2S2
Molecular Weight:
118.1807
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$15
- +
25g
98%
In Stock USA
United States
$50
- +
100g
98%
In Stock USA
United States
$150
- +
500g
98%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003HHZ
Chemical Name:
2-Mercapto-1,3,4-thiadiazole
CAS Number:
18686-82-3
Molecular Formula:
C2H2N2S2
Molecular Weight:
118.1807
MDL Number:
MFCD00040404
IUPAC Name:
3H-1,3,4-thiadiazole-2-thione
InChI:
InChI=1S/C2H2N2S2/c5-2-4-3-1-6-2/h1H,(H,4,5)
InChI Key:
JLAMDELLBBZOOX-UHFFFAOYSA-N
SMILES:
Sc1nncs1
EC Number:
242-504-5
NSC Number:
184817
Properties
Complexity:
97.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.966g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
118.172g/mol
Monoisotopic Mass:
117.966g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
N-heterocyclic dicarboxylic acids: broad-spectrum inhibitors of metallo-β-lactamases with co-antibacterial effect against antibiotic-resistant bacteria. Bioorganic & medicinal chemistry letters 20120815
5-Eth-oxy-1,3,4-thia-diazole-2(3H)-thione. Acta crystallographica. Section E, Structure reports online 20120201
Novel biotransformation process of podophyllotoxin to 4 β-sulfur-substituted podophyllum derivates with anti-tumor activity by Penicillium purpurogenum Y.J. Tang. Current medicinal chemistry 20120101
N-(5-Sulfanyl-idene-4,5-dihydro-1,3,4-thia-diazol-2-yl)acetamide dimethyl sulfoxide disolvate. Acta crystallographica. Section E, Structure reports online 20120101
Solid phase extraction of trace amounts of Ag, Cd, Cu, and Zn in environmental samples using magnetic nanoparticles coated by 3-(trimethoxysilyl)-1-propantiol and modified with 2-amino-5-mercapto-1,3,4-thiadiazole and their determination by ICP-OES. Journal of hazardous materials 20110615
A facile synthesis and anticancer activity evaluation of spiro[thiazolidinone-isatin] conjugates. Scientia pharmaceutica 20110101
2,2'-Bi-1,3,4-thia-diazole-5,5'-diamine tetra-hydrate. Acta crystallographica. Section E, Structure reports online 20100901
Bis(1,3,4-thia-diazol-2-yl) disulfide. Acta crystallographica. Section E, Structure reports online 20091001
Quantitative structure-activity relationship (QSAR) studies on a series of 1,3,4-thiadiazole-2-thione derivatives as tumor-associated carbonic anhydrase IX inhibitors. Journal of enzyme inhibition and medicinal chemistry 20090601
[5-(4-Bromo-phenoxy-meth-yl)-1,3,4-thia-diazole-2-thiol-ato]triphenyl-tin(IV). Acta crystallographica. Section E, Structure reports online 20090501
Design, synthesis, and docking studies of new 1,3,4-thiadiazole-2-thione derivatives with carbonic anhydrase inhibitory activity. Bioorganic & medicinal chemistry 20071115
Properties