| CAS Number | 1049743-03-4 |
| Catalog Number | AG00HAIM(AGN-PC-0WR029) |
| Chemical Name | 4-(4-Benzylphenyl)-1,3-thiazol-2-amine, HBr |
| IUPAC Name | 4-(4-benzylphenyl)-1,3-thiazol-2-amine;hydrobromide |
| InChI | InChI=1S/C16H14N2S.BrH/c17-16-18-15(11-19-16)14-8-6-13(7-9-14)10-12-4-2-1-3-5-12;/h1-9,11H,10H2,(H2,17,18);1H |
| InChI Key | JNODWABIDXRUJK-UHFFFAOYSA-N |
| MDL Number | MFCD06653257 |
| Molecular Formula | C16H15BrN2S |
| Molecular Weight | 347.2727 |
| SMILES | Br.NC1SC=C(C2=CC=C(CC3=CC=CC=C3)C=C2)N=1 |
| Synonyms | 1049743-03-4,
4-(4-Benzylphenyl)-1,3-thiazol-2-amine, HBr,
4-(4-BENZYLPHENYL)-1,3-THIAZOL-2-AMINE HYDROBROMIDE,
ARM1 hydrobromide,
ATI-0188,
ZX-BK001075,
MFCD06653257,
AKOS001476578,
4-(4-Benzylphenyl)-1,3-thiazol-2-amine HBr,
4-(4-benzylphenyl)thiazol-2-amine hydrobromide,
K-0464,
ARM1,
68729-05-5,
|
| Complexity | 270 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 346.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 347.274g/mol |
| Monoisotopic Mass | 346.014g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number