| CAS Number | 1414661-49-6 |
| Catalog Number | AG01F9JL(AGN-PC-3H49CL) |
| Chemical Name | 2-(3-(1H-Benzo[d]imidazol-2-yl)phenyl)-4-phenylthiazole |
| IUPAC Name | 2-[3-(1H-benzimidazol-2-yl)phenyl]-4-phenyl-1,3-thiazole |
| InChI | InChI=1S/C22H15N3S/c1-2-7-15(8-3-1)20-14-26-22(25-20)17-10-6-9-16(13-17)21-23-18-11-4-5-12-19(18)24-21/h1-14H,(H,23,24) |
| InChI Key | AQFJESQNSPPQDH-UHFFFAOYSA-N |
| MDL Number | MFCD22666466 |
| Molecular Formula | C22H15N3S |
| Molecular Weight | 353.4396 |
| SMILES | c1ccc(cc1)c1csc(n1)c1cccc(c1)c1nc2c([nH]1)cccc2 |
| Synonyms | 1414661-49-6,
2-[3-(2-Benzimidazolyl)phenyl]-4-phenylthiazole,
2-[3-(2-Benzimidazolyl)phenyl)]-4-phenylthiazole,
2-(3-(1H-Benzo[d]imidazol-2-yl)phenyl)-4-phenylthiazole,
MFCD22666466,
ZINC85999933,
AKOS027440146,
2-[3-(2-Benzimidazolyl)-phenyl)-4-phenylthiazole, AldrichCPR,
|
| Complexity | 466 |
| 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