| CAS Number | 1292577-03-7 |
| Catalog Number | AG01A3NI |
| Chemical Name | 6-chloro-N-(2,4-dimethoxyphenyl)pyrimidin-4-amine |
| IUPAC Name | 6-chloro-N-(2,4-dimethoxyphenyl)pyrimidin-4-amine |
| InChI | InChI=1S/C12H12ClN3O2/c1-17-8-3-4-9(10(5-8)18-2)16-12-6-11(13)14-7-15-12/h3-7H,1-2H3,(H,14,15,16) |
| InChI Key | GCRMTOYTRWLDCI-UHFFFAOYSA-N |
| MDL Number | MFCD13225368 |
| Molecular Formula | C12H12ClN3O2 |
| Molecular Weight | 265.6956 |
| SMILES | COC1=CC(OC)=C(NC2=NC=NC(Cl)=C2)C=C1 |
| Synonyms | 6-chloro-N-(2,4-dimethoxyphenyl)pyrimidin-4-amine,
1292577-03-7,
SCHEMBL15271412,
GCRMTOYTRWLDCI-UHFFFAOYSA-N,
ZINC40431960,
AKOS009154468,
NE15748,
|
| Complexity | 258 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.697g/mol |
| Monoisotopic Mass | 265.062g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 56.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number