| CAS Number | 1965304-74-8 |
| Catalog Number | AG01FB2V(AGN-PC-3H49HF) |
| Chemical Name | 2-(2-Pyrimidyl)-4-(2-hydroxyphenyl)thiazole |
| IUPAC Name | 2-(2-pyrimidin-2-yl-1,3-thiazol-4-yl)phenol |
| InChI | InChI=1S/C13H9N3OS/c17-11-5-2-1-4-9(11)10-8-18-13(16-10)12-14-6-3-7-15-12/h1-8,17H |
| InChI Key | PIABKNBHTQXCHG-UHFFFAOYSA-N |
| MDL Number | MFCD28166222 |
| Molecular Formula | C13H9N3OS |
| Molecular Weight | 255.2951 |
| SMILES | N1=C(N=CC=C1)C=1SC=C(N1)C1=C(C=CC=C1)O |
| Synonyms | 2-(2-Pyrimidyl)-4-(2-hydroxyphenyl)thiazole,
1965304-74-8,
ZINC219039573,
2-(2-Pyrimidyl)-4-(2-hydroxyphenyl)thiazole, AldrichCPR,
|
| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.295g/mol |
| Monoisotopic Mass | 255.047g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 87.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number