| CAS Number | 1306605-46-8 |
| Catalog Number | AG01AIG8(AGN-PC-0WO5SI) |
| Chemical Name | 4-(2-amino-1,3-thiazol-4-yl)-5-methylfuran-2-carboxamide |
| IUPAC Name | 4-(2-amino-1,3-thiazol-4-yl)-5-methylfuran-2-carboxamide |
| InChI | InChI=1S/C9H9N3O2S/c1-4-5(2-7(14-4)8(10)13)6-3-15-9(11)12-6/h2-3H,1H3,(H2,10,13)(H2,11,12) |
| InChI Key | IIFWPSIDMQDEHY-UHFFFAOYSA-N |
| MDL Number | MFCD18839071 |
| Molecular Formula | C9H9N3O2S |
| Molecular Weight | 223.2517 |
| SMILES | CC1=C(C2N=C(N)SC=2)C=C(C(N)=O)O1 |
| Synonyms | 4-(2-amino-1,3-thiazol-4-yl)-5-methylfuran-2-carboxamide,
1306605-46-8,
EN300-77715,
ZINC68592027,
AKOS026727979,
MCULE-6950035773,
NE48979,
Z1199457435,
|
| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.25g/mol |
| Monoisotopic Mass | 223.042g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 123A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number