| CAS Number | 837423-56-0 |
| Catalog Number | AG019F01 |
| Chemical Name | 2-Chloro-N-(2,4-dimethoxyphenyl)-4-pyrimidinamine |
| IUPAC Name | 2-chloro-N-(2,4-dimethoxyphenyl)pyrimidin-4-amine |
| InChI | InChI=1S/C12H12ClN3O2/c1-17-8-3-4-9(10(7-8)18-2)15-11-5-6-14-12(13)16-11/h3-7H,1-2H3,(H,14,15,16) |
| InChI Key | WIAYOVNMHFHMSM-UHFFFAOYSA-N |
| MDL Number | MFCD17293254 |
| Molecular Formula | C12H12ClN3O2 |
| Molecular Weight | 265.6956 |
| SMILES | COC1=CC=C(NC2=NC(Cl)=NC=C2)C(OC)=C1 |
| Synonyms | 2-chloro-N-(2,4-dimethoxyphenyl)pyrimidin-4-amine,
837423-56-0,
2-chloro-N-(2,4-dimethoxyphenyl)-4-Pyrimidinamine,
SCHEMBL4820325,
MFCD17293254,
ZINC36472499,
AKOS006031367,
DA-02961,
CS-0062081,
CID11844622,
|
| 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
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number