| CAS Number | 1193388-79-2 |
| Catalog Number | AG019WG0 |
| Chemical Name | N-(4-fluorophenyl)-N-(4-formyl-1,3-thiazol-2-yl)acetamide |
| IUPAC Name | N-(4-fluorophenyl)-N-(4-formyl-1,3-thiazol-2-yl)acetamide |
| InChI | InChI=1S/C12H9FN2O2S/c1-8(17)15(11-4-2-9(13)3-5-11)12-14-10(6-16)7-18-12/h2-7H,1H3 |
| InChI Key | ZJFCQJCSLNUPAY-UHFFFAOYSA-N |
| MDL Number | MFCD12913022 |
| Molecular Formula | C12H9FN2O2S |
| Molecular Weight | 264.2755 |
| SMILES | CC(N(C1=CC=C(F)C=C1)C1SC=C(C=O)N=1)=O |
| Synonyms | N-(4-fluorophenyl)-N-(4-formyl-1,3-thiazol-2-yl)acetamide,
1193388-79-2,
AC1Q1K7C,
CTK7I0512,
ZINC36379798,
AKOS030700148,
MCULE-5847985127,
NE21150,
EN300-51840,
|
| Complexity | 321 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 264.037g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.274g/mol |
| Monoisotopic Mass | 264.037g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 78.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number