| CAS Number | 159091-88-0 |
| Catalog Number | AG019H7M(AGN-PC-0KF425) |
| Chemical Name | (4,5-Dihydro-thiazol-2-yl)-(3,4-dimethoxy-phenyl)-amine |
| IUPAC Name | N-(3,4-dimethoxyphenyl)-4,5-dihydro-1,3-thiazol-2-amine |
| InChI | InChI=1S/C11H14N2O2S/c1-14-9-4-3-8(7-10(9)15-2)13-11-12-5-6-16-11/h3-4,7H,5-6H2,1-2H3,(H,12,13) |
| InChI Key | VYBBZPLTWFVJQI-UHFFFAOYSA-N |
| MDL Number | MFCD03476346 |
| Molecular Formula | C11H14N2O2S |
| Molecular Weight | 238.3061 |
| SMILES | COC1=C(OC)C=C(NC2SCCN=2)C=C1 |
| Synonyms | N-(3,4-dimethoxyphenyl)-4,5-dihydro-1,3-thiazol-2-amine,
159091-88-0,
(4,5-Dihydro-thiazol-2-yl)-(3,4-dimethoxy-phenyl)-amine,
AC1Q4DET,
AC1M6CZ8,
CTK6J7551,
ZINC3228258,
SBB038458,
AKOS000116086,
NE26927,
EN300-02807,
(3,4-dimethoxyphenyl)-1,3-thiazolin-2-ylamine,
ZINC03228258,
CID2346408,
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.305g/mol |
| Monoisotopic Mass | 238.078g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 68.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number