![S-[2-(1-Piperidinyl)ethyl] ethanethioate structure](/static/products/177/177545-96-9.png)
S-[2-(1-Piperidinyl)ethyl] ethanethioate
TL;DR: S-[2-(1-Piperidinyl)ethyl] ethanethioate (CAS 177545-96-9) is a chemical compound with molecular formula C9H17NOS and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-piperidin-1-ylethyl) ethanethioate
Also Known As: S-[2-(1-Piperidinyl)ethyl] ethanethioate, S-(2-piperidin-1-ylethyl) ethanethioate, S-[2-(Piperidin-1-yl)ethyl] ethanethioate
| Molecular Formula | C9H17NOS |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | 1.752 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.10309 |
| Heavy Atoms | 12 |
| Complexity | 143.46396 |
Chemical Identifiers
| CAS Number | 177545-96-9 |
|---|---|
| SMILES | CC(=O)SCCN1CCCCC1 |
Product Overview
S-[2-(1-Piperidinyl)ethyl] ethanethioate (CAS 177545-96-9), with molecular formula C9H17NOS and molecular weight 187.10 g/mol. IUPAC: S-(2-piperidin-1-ylethyl) ethanethioate.
Chemical Property Profile of S-[2-(1-Piperidinyl)ethyl] ethanethioate
Property Insights of S-[2-(1-Piperidinyl)ethyl] ethanethioate
The XLogP value of 1.752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-[2-(1-Piperidinyl)ethyl] ethanethioate. With a topological polar surface area (TPSA) of 20.31 Ų, S-[2-(1-Piperidinyl)ethyl] ethanethioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-[2-(1-Piperidinyl)ethyl] ethanethioate has 0 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 S-[2-(1-Piperidinyl)ethyl] ethanethioate?
The CAS number of S-[2-(1-Piperidinyl)ethyl] ethanethioate is 177545-96-9.
What is the molecular formula of S-[2-(1-Piperidinyl)ethyl] ethanethioate?
The molecular formula of S-[2-(1-Piperidinyl)ethyl] ethanethioate is C9H17NOS.
What is the molecular weight of S-[2-(1-Piperidinyl)ethyl] ethanethioate?
The molecular weight of S-[2-(1-Piperidinyl)ethyl] ethanethioate is 187.10 g/mol.
Where can I buy S-[2-(1-Piperidinyl)ethyl] ethanethioate?
You can request a quote for S-[2-(1-Piperidinyl)ethyl] ethanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-[2-(1-Piperidinyl)ethyl] ethanethioate?
Yes, KEHONG BIO provides custom synthesis services for S-[2-(1-Piperidinyl)ethyl] ethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.