| CAS Number | 1414661-82-7 |
| Catalog Number | AG01F9UJ(AGN-PC-3H49DF) |
| Chemical Name | 2-(4-(1H-Benzo[d]imidazol-2-yl)phenyl)-4-phenylthiazole |
| IUPAC Name | 2-[4-(1H-benzimidazol-2-yl)phenyl]-4-phenyl-1,3-thiazole |
| InChI | InChI=1S/C22H15N3S/c1-2-6-15(7-3-1)20-14-26-22(25-20)17-12-10-16(11-13-17)21-23-18-8-4-5-9-19(18)24-21/h1-14H,(H,23,24) |
| InChI Key | TVXDBHBOTNOKBV-UHFFFAOYSA-N |
| MDL Number | MFCD22988971 |
| Molecular Formula | C22H15N3S |
| Molecular Weight | 353.4396 |
| SMILES | c1ccc(cc1)c1csc(n1)c1ccc(cc1)c1nc2c([nH]1)cccc2 |
| Synonyms | 1414661-82-7,
2-[4-(2-Benzimidazolyl)phenyl]-4-phenylthiazole,
2-(4-(1H-Benzo[d]imidazol-2-yl)phenyl)-4-phenylthiazole,
MFCD22988971,
ZINC85999941,
2-[4-(2-Benzimidazolyl)-phenyl]-4-phenylthiazole, AldrichCPR,
|
| Complexity | 458 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 353.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 353.443g/mol |
| Monoisotopic Mass | 353.099g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 69.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.6 |
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Certificate of Analysis
Lot Number