| CAS Number | 82302-19-0 |
| Catalog Number | AG01A9XC(AGN-PC-0L46AW) |
| Chemical Name | 4-Amino-2-methylpyrimidine-5-carbothioamide |
| IUPAC Name | 4-amino-2-methylpyrimidine-5-carbothioamide |
| InChI | InChI=1S/C6H8N4S/c1-3-9-2-4(6(8)11)5(7)10-3/h2H,1H3,(H2,8,11)(H2,7,9,10) |
| InChI Key | HYRSYLSTXKOYMA-UHFFFAOYSA-N |
| MDL Number | MFCD16817482 |
| Molecular Formula | C6H8N4S |
| Molecular Weight | 168.2195 |
| NSC Number | 266172 |
| SMILES | CC1=NC(N)=C(C(N)=S)C=N1 |
| Synonyms | 4-amino-2-methylpyrimidine-5-carbothioamide,
82302-19-0,
NSC266172,
AC1N1POS,
AC1Q2OYX,
SCHEMBL11256406,
DTXSID90398665,
HYRSYLSTXKOYMA-UHFFFAOYSA-N,
ZINC5579929,
AKOS026730352,
NE30311,
NSC-266172,
4-Amino-2-methyl-5-pyrimidinecarbothioamide,
EN300-66443,
CID4034176,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.218g/mol |
| Monoisotopic Mass | 168.047g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 110A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number