Acetic acid, 2-(2-amino-5-chloro-6-methyl-4-pyrimidylthio)-, ethyl ester
ethyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate
Also Known As: CBKinase1_001045|CBKinase1_013445|BAS 01321871|SR-01000451485-1|BRD-K02107547-001-01-4|BRD-K02107547-001-08-9|ethyl [(2-amino-5-chloro-6-methyl-4-pyrimidinyl)thio]acetate|ethyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-ylthio)acetate|Ethyl [(2-amino-5-chloro-6-methyl-4-pyrimidinyl)sulfanyl]acetate #|ethyl [(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanyl]acetate|ethyl 2-((2-amino-5-chloro-6-methylpyrimidin-4-yl)thio)acetate|ethyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate|(2-Amino-5-chloro-6-methyl-pyrimidin-4-ylsulfanyl)-acetic acid ethyl ester|Acetic acid, 2-(2-amino-5-chloro-6-methyl-4-pyrimidylthio)-, ethyl ester|ETHYL 2-[(2-AMINO-5-CHLORO-6-METHYLPYRIMIDIN-4-YL)SULFANYL]ACETATE
| Molecular Formula | C9H12ClN3O2S |
|---|---|
| Molecular Weight | 261.03387 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.03387 |
| Monoisotopic Mass | 261.03387 |
| Heavy Atoms | 16 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 362002-50-4 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC(=NC(=C1Cl)C)N |
| InChIKey | ZMZXXPDLOGZBHO-UHFFFAOYSA-N |
Product Overview
Acetic acid, 2-(2-amino-5-chloro-6-methyl-4-pyrimidylthio)-, ethyl ester (CAS 362002-50-4), with molecular formula C9H12ClN3O2S and molecular weight 261.03387 g/mol. IUPAC: ethyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate.