| CAS Number | 1306605-02-6 |
| Catalog Number | AG01AHME(AGN-PC-0WO6IK) |
| Chemical Name | Imidazo[4,3-b][1,3]thiazole-3-carboxylic acid |
| IUPAC Name | imidazo[5,1-b][1,3]thiazole-3-carboxylic acid |
| InChI | InChI=1S/C6H4N2O2S/c9-6(10)4-2-11-5-1-7-3-8(4)5/h1-3H,(H,9,10) |
| InChI Key | GGLOUSFVLGNFKZ-UHFFFAOYSA-N |
| MDL Number | MFCD18838686 |
| Molecular Formula | C6H4N2O2S |
| Molecular Weight | 168.1732 |
| SMILES | OC(C1N2C(=CN=C2)SC=1)=O |
| Synonyms | imidazo[4,3-b][1,3]thiazole-3-carboxylic acid,
1306605-02-6,
ZINC68590010,
AKOS015868278,
MCULE-1672336585,
NE44203,
EN300-75179,
Z1278581707,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.17g/mol |
| Monoisotopic Mass | 167.999g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 82.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number