1-(Thioacetyl)piperidine
TL;DR: 1-(Thioacetyl)piperidine (CAS 57228-56-5) is a chemical compound with molecular formula C7H13NS and molecular weight 143.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-piperidin-1-ylethanethione
Also Known As: 1-(THIOACETYL)PIPERIDINE, 1-(piperidin-1-yl)ethanethione, Thioessigsaeure-piperidid, 1-piperidin-1-ylethanethione, 1-(1-Piperidinyl)ethanethione
| Molecular Formula | C7H13NS |
|---|---|
| Molecular Weight | 143.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 143.07687 |
| Heavy Atoms | 9 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 57228-56-5 |
|---|---|
| SMILES | CC(=S)N1CCCCC1 |
| InChIKey | KMHCVLQYILLNSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Thioacetyl)piperidine (CAS 57228-56-5), with molecular formula C7H13NS and molecular weight 143.08 g/mol. IUPAC: 1-piperidin-1-ylethanethione.
Chemical Property Profile of 1-(Thioacetyl)piperidine
Property Insights of 1-(Thioacetyl)piperidine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Thioacetyl)piperidine. With a topological polar surface area (TPSA) of 35.3 Ų, 1-(Thioacetyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Thioacetyl)piperidine has 0 hydrogen bond donor(s) and 1 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 1-(Thioacetyl)piperidine?
The CAS number of 1-(Thioacetyl)piperidine is 57228-56-5.
What is the molecular formula of 1-(Thioacetyl)piperidine?
The molecular formula of 1-(Thioacetyl)piperidine is C7H13NS.
What is the molecular weight of 1-(Thioacetyl)piperidine?
The molecular weight of 1-(Thioacetyl)piperidine is 143.08 g/mol.
Where can I buy 1-(Thioacetyl)piperidine?
You can request a quote for 1-(Thioacetyl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Thioacetyl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Thioacetyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.