| CAS Number | 1193390-14-5 |
| Catalog Number | AG019WD9 |
| Chemical Name | N-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(4-fluorophenyl)acetamide |
| IUPAC Name | N-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(4-fluorophenyl)acetamide |
| InChI | InChI=1S/C12H10ClFN2OS/c1-8(17)16(11-4-2-9(14)3-5-11)12-15-10(6-13)7-18-12/h2-5,7H,6H2,1H3 |
| InChI Key | OVSLGBMBFQUOGJ-UHFFFAOYSA-N |
| MDL Number | MFCD12912980 |
| Molecular Formula | C12H10ClFN2OS |
| Molecular Weight | 284.7370 |
| SMILES | CC(N(C1=CC=C(F)C=C1)C1SC=C(CCl)N=1)=O |
| Synonyms | N-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(4-fluorophenyl)acetamide,
1193390-14-5,
CTK6H6818,
ZINC36379765,
NE30323,
EN300-51533,
AC1Q1K7T,
|
| Complexity | 300 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 284.01864g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284.74g/mol |
| Monoisotopic Mass | 284.01864g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.4Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number