| CAS Number | 1256482-99-1 |
| Catalog Number | AG01FC9D(AGN-PC-3H49LF) |
| Chemical Name | 2-(3-Methylpyridin-2-yl)-4-phenylthiazole |
| IUPAC Name | 2-(3-methylpyridin-2-yl)-4-phenyl-1,3-thiazole |
| InChI | InChI=1S/C15H12N2S/c1-11-6-5-9-16-14(11)15-17-13(10-18-15)12-7-3-2-4-8-12/h2-10H,1H3 |
| InChI Key | CPAHJLLDGODHBW-UHFFFAOYSA-N |
| MDL Number | MFCD16658848 |
| Molecular Formula | C15H12N2S |
| Molecular Weight | 252.3342 |
| SMILES | Cc1cccnc1c1scc(n1)c1ccccc1 |
| Synonyms | 2-(3-methyl-2-pyridyl)-4-phenylthiazole,
1256482-99-1,
2-(3-Methylpyridin-2-yl)-4-phenylthiazole,
MFCD16658848,
ZINC72284224,
2-(3-Methyl-2-pyridyl)-4-phenylthiazole, AldrichCPR,
|
| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.335g/mol |
| Monoisotopic Mass | 252.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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Certificate of Analysis
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