2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid
TL;DR: 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid (CAS 6499-12-3) is a chemical compound with molecular formula C9H15NO2S2 and molecular weight 233.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic acid
Also Known As: 2-(4-methylpiperidine-1-carbothioylsulfanyl)acetic acid, 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid, 2-((4-Methylpiperidine-1-carbonothioyl)thio)acetic acid, ([(4-Methylpiperidin-1-yl)carbonothioyl]thio)acetic acid, {[(4-methylpiperidin-1-yl)carbonothioyl]thio}acetic acid
| Molecular Formula | C9H15NO2S2 |
|---|---|
| Molecular Weight | 233.05 g/mol |
| LogP | 1.821 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.05443 |
| Heavy Atoms | 14 |
| Complexity | 224.85184 |
Chemical Identifiers
| CAS Number | 6499-12-3 |
|---|---|
| SMILES | CC1CCN(CC1)C(=S)SCC(=O)O |
Product Overview
2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid (CAS 6499-12-3), with molecular formula C9H15NO2S2 and molecular weight 233.05 g/mol. IUPAC: 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic acid.
Chemical Property Profile of 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid
Property Insights of 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid
The XLogP value of 1.821 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid. With a topological polar surface area (TPSA) of 40.54 Ų, 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid has 1 hydrogen bond donor(s) and 3 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 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid?
The CAS number of 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid is 6499-12-3.
What is the molecular formula of 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid?
The molecular formula of 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid is C9H15NO2S2.
What is the molecular weight of 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid?
The molecular weight of 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid is 233.05 g/mol.
Where can I buy 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid?
You can request a quote for 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.