| CAS Number | 1421262-11-4 |
| Catalog Number | AG01F8J9(AGN-PC-3H49A1) |
| Chemical Name | 4-(Pyridin-4-yl)-2-(4-(trifluoromethyl)phenyl)thiazole |
| IUPAC Name | 4-pyridin-4-yl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole |
| InChI | InChI=1S/C15H9F3N2S/c16-15(17,18)12-3-1-11(2-4-12)14-20-13(9-21-14)10-5-7-19-8-6-10/h1-9H |
| InChI Key | IMKDHTFBSNGBDQ-UHFFFAOYSA-N |
| MDL Number | MFCD22682984 |
| Molecular Formula | C15H9F3N2S |
| Molecular Weight | 306.3056 |
| SMILES | FC(c1ccc(cc1)c1scc(n1)c1ccncc1)(F)F |
| Synonyms | 1421262-11-4,
4-(4-Pyridyl)-2-[4-(trifluoromethyl)phenyl]-thiazole,
4-(Pyridin-4-yl)-2-(4-(trifluoromethyl)phenyl)thiazole,
MFCD22682984,
ZINC84847072,
4-(4-Pyridyl)-2-[4-(trifluoromethyl)phenyl]thiazole,
|
| Complexity | 336 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 306.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 306.306g/mol |
| Monoisotopic Mass | 306.044g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
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Certificate of Analysis
Lot Number