![Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate structure](/static/products/852/852399-63-4.png)
Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate
TL;DR: Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate (CAS 852399-63-4) is a chemical compound with molecular formula C11H19NO2S2 and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2,6-dimethylpiperidine-1-carbothioyl)sulfanylacetate
Also Known As: methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate, methyl 2-(2,6-dimethylpiperidine-1-carbothioylsulfanyl)acetate, methyl 2-(2,6-dimethylpiperidine-1-carbothioyl)sulfanylacetate, Methyl [(2,6-dimethylpiperidine-1-carbothioyl)sulfanyl]acetate, methyl2-(2,6-dimethylpiperidine-1-carbothioylsulfanyl)acetate
| Molecular Formula | C11H19NO2S2 |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 2.4404 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.08572 |
| Heavy Atoms | 16 |
| Complexity | 260.71017 |
Chemical Identifiers
| CAS Number | 852399-63-4 |
|---|---|
| SMILES | CC1CCCC(N1C(=S)SCC(=O)OC)C |
Product Overview
Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate (CAS 852399-63-4), with molecular formula C11H19NO2S2 and molecular weight 261.09 g/mol. IUPAC: methyl 2-(2,6-dimethylpiperidine-1-carbothioyl)sulfanylacetate.
Chemical Property Profile of Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate
Property Insights of Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate
The XLogP value of 2.4404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate. With a topological polar surface area (TPSA) of 29.54 Ų, Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate has 0 hydrogen bond donor(s) and 4 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 {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate?
The CAS number of Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate is 852399-63-4.
What is the molecular formula of Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate?
The molecular formula of Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate is C11H19NO2S2.
What is the molecular weight of Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate?
The molecular weight of Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate is 261.09 g/mol.
Where can I buy Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate?
You can request a quote for Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl {[(2,6-dimethylpiperidin-1-yl)carbonothioyl]thio}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.