| CAS Number | 1965304-82-8 |
| Catalog Number | AG01EUGM(AGN-PC-3H47IO) |
| Chemical Name | 1,3-Bis(4-phenyl-5-methylthiazol-2-yl)benzene |
| IUPAC Name | 5-methyl-2-[3-(5-methyl-4-phenyl-1,3-thiazol-2-yl)phenyl]-4-phenyl-1,3-thiazole |
| InChI | InChI=1S/C26H20N2S2/c1-17-23(19-10-5-3-6-11-19)27-25(29-17)21-14-9-15-22(16-21)26-28-24(18(2)30-26)20-12-7-4-8-13-20/h3-16H,1-2H3 |
| InChI Key | AGJFYXKUZNOTAU-UHFFFAOYSA-N |
| MDL Number | MFCD28166238 |
| Molecular Formula | C26H20N2S2 |
| Molecular Weight | 424.5804 |
| SMILES | C1(C2=NC(C3C=CC=CC=3)=C(C)S2)C=CC=C(C2=NC(C3C=CC=CC=3)=C(C)S2)C=1 |
| Synonyms | 1,3-Bis(4-phenyl-5-methylthiazol-2-yl)benzene,
1965304-82-8,
ZINC219040749,
1,3-Bis(4-phenyl-5-methylthiazol-2-yl)benzene, AldrichCPR,
|
| Complexity | 499 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 424.107g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 30 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 424.58g/mol |
| Monoisotopic Mass | 424.107g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 82.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 7.4 |
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Certificate of Analysis
Lot Number