| CAS Number | 333388-03-7 |
| Catalog Number | AG00C9T5 |
| Chemical Name | 4,6-Dichloro-2-(methylthio)-5-pyrimidineamine |
| IUPAC Name | 4,6-dichloro-2-methylsulfanylpyrimidin-5-amine |
| InChI | InChI=1S/C5H5Cl2N3S/c1-11-5-9-3(6)2(8)4(7)10-5/h8H2,1H3 |
| InChI Key | RYDZQZVTGOIZNX-UHFFFAOYSA-N |
| MDL Number | MFCD01708037 |
| Molecular Formula | C5H5Cl2N3S |
| Molecular Weight | 210.0843 |
| SMILES | NC1=C(Cl)N=C(SC)N=C1Cl |
| Synonyms | 333388-03-7,
4,6-Dichloro-2-(methylthio)pyrimidin-5-amine,
4,6-Dichloro-2-(methylthio)-5-pyrimidineamine,
4,6-dichloro-2-methylsulfanyl-pyrimidin-5-ylamine,
SCHEMBL1061788,
RYDZQZVTGOIZNX-UHFFFAOYSA-N,
ZX-RL005059,
ZINC95616375,
FCH1962888,
OR307015,
CS-0045974,
4,6-dichloro-2-methylsulfanylpyrimidin-5-amine,
C-0620,
4,6-dichloro-2-(methylthio) pyrimidin-5-amine,
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| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.958124g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.08g/mol |
| Monoisotopic Mass | 208.958124g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 77.1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number