Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate
TL;DR: Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate (CAS 337494-45-8) is a chemical compound with molecular formula C8H10ClN3O2S and molecular weight 247.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate
Also Known As: BAS 01321863, Methyl 2-((2-amino-5-chloro-6-methylpyrimidin-4-yl)thio)acetate, methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate, methyl [(2-amino-5-chloro-6-methylpyrimidin-4-yl)thio]acetate, A2541/0108131
| Molecular Formula | C8H10ClN3O2S |
|---|---|
| Molecular Weight | 247.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.01822 |
| Heavy Atoms | 15 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 337494-45-8 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)N)SCC(=O)OC)Cl |
| InChIKey | ZSZGSVUAJXBFPZ-UHFFFAOYSA-N |
Product Overview
Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate (CAS 337494-45-8), with molecular formula C8H10ClN3O2S and molecular weight 247.02 g/mol. IUPAC: methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate.
Chemical Property Profile of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate
Property Insights of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate. Following Lipinski's Rule of Five, Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate?
The CAS number of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate is 337494-45-8.
What is the molecular formula of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate?
The molecular formula of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate is C8H10ClN3O2S.
What is the molecular weight of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate?
The molecular weight of Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate is 247.02 g/mol.
Where can I buy Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate?
You can request a quote for Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(2-amino-5-chloro-6-methylpyrimidin-4-yl)sulfanylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.