200,000+ products from a single source!
sales@angenechem.com
13368-86-0 | 1,2,5-Thiadiazole-3-carboxylic acid
CAS No: 13368-86-0 Catalog No: AG003850 MDL No:MFCD06254776
Product Description
Catalog Number:
AG003850
Chemical Name:
1,2,5-Thiadiazole-3-carboxylic acid
CAS Number:
13368-86-0
Molecular Formula:
C3H2N2O2S
Molecular Weight:
130.1252
MDL Number:
MFCD06254776
IUPAC Name:
1,2,5-thiadiazole-3-carboxylic acid
InChI:
InChI=1S/C3H2N2O2S/c6-3(7)2-1-4-8-5-2/h1H,(H,6,7)
InChI Key:
GFTBMBHVZZFGCK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnsn1
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.984g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
130.121g/mol
Monoisotopic Mass:
129.984g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Agonist lead identification for the high affinity niacin receptor GPR109a. | Bioorganic & medicinal chemistry letters 20070901 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.