| CAS Number | 923832-32-0 |
| Catalog Number | AG019W8Q(AGN-PC-0WO36H) |
| Chemical Name | 2-(Dimethylamino)thieno[2,3-d][1,3]thiazole-5-carboxylic acid |
| IUPAC Name | 2-(dimethylamino)thieno[2,3-d][1,3]thiazole-5-carboxylic acid |
| InChI | InChI=1S/C8H8N2O2S2/c1-10(2)8-9-6-4(14-8)3-5(13-6)7(11)12/h3H,1-2H3,(H,11,12) |
| InChI Key | QABBWHGWPVGGTN-UHFFFAOYSA-N |
| MDL Number | MFCD08445083 |
| Molecular Formula | C8H8N2O2S2 |
| Molecular Weight | 228.2913 |
| SMILES | CN(C1SC2=C(SC(C(O)=O)=C2)N=1)C |
| Synonyms | 2-(dimethylamino)thieno[2,3-d][1,3]thiazole-5-carboxylic acid,
923832-32-0,
AC1Q3WK9,
CTK6I0043,
ZINC20285100,
AKOS000138260,
MCULE-3856164170,
EN300-51062,
Z228589198,
2-(dimethylamino)thieno[2,3-d]thiazole-5-carboxylic acid,
2-Dimethylamino-thieno[2,3-d]thiazole-5-carboxylic acid,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.003g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.284g/mol |
| Monoisotopic Mass | 228.003g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 110A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number