| CAS Number | 501650-75-5 |
| Catalog Number | AG019KDZ |
| Chemical Name | 4-(5-chloro-1-benzofuran-2-yl)-1,3-thiazol-2-amine |
| IUPAC Name | 4-(5-chloro-1-benzofuran-2-yl)-1,3-thiazol-2-amine |
| InChI | InChI=1S/C11H7ClN2OS/c12-7-1-2-9-6(3-7)4-10(15-9)8-5-16-11(13)14-8/h1-5H,(H2,13,14) |
| InChI Key | FSYXNASYROAEQB-UHFFFAOYSA-N |
| MDL Number | MFCD04071366 |
| Molecular Formula | C11H7ClN2OS |
| Molecular Weight | 250.7041 |
| SMILES | NC1SC=C(C2OC3=C(C=C(C=C3)Cl)C=2)N=1 |
| Synonyms | 4-(5-chloro-1-benzofuran-2-yl)-1,3-thiazol-2-amine,
501650-75-5,
Cyto3F7,
Oprea1_402843,
CTK6H1988,
ZINC17124357,
AKOS001359216,
MCULE-9153959295,
NE58741,
ST51022745,
EN300-26566,
BRD-K68041112-004-01-5,
4-(5-chlorobenzo[d]furan-2-yl)-1,3-thiazole-2-ylamine,
Z118590720,
AC1L8UOO,
AC1Q52MK,
CID433048,
NSC321501,
|
| Complexity | 268 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.996762g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.7g/mol |
| Monoisotopic Mass | 249.996762g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 80.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number