6-Thioxo-2-piperidone
TL;DR: 6-Thioxo-2-piperidone (CAS 5693-95-8) is a chemical compound with molecular formula C5H7NOS and molecular weight 129.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-sulfanylidenepiperidin-2-one
Also Known As: Thioglutarimide, Monothioglutarimide, Glutarimide, 2-thio-, Glutarimide, thio-, 2-Piperidinone, 6-thioxo-
| Molecular Formula | C5H7NOS |
|---|---|
| Molecular Weight | 129.02 g/mol |
| LogP | 0.6139 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 129.02484 |
| Heavy Atoms | 8 |
| Complexity | 118.39036 |
Chemical Identifiers
| CAS Number | 5693-95-8 |
|---|---|
| SMILES | C1CC(=O)NC(=S)C1 |
Product Overview
6-Thioxo-2-piperidone (CAS 5693-95-8), with molecular formula C5H7NOS and molecular weight 129.02 g/mol. IUPAC: 6-sulfanylidenepiperidin-2-one.
Chemical Property Profile of 6-Thioxo-2-piperidone
Property Insights of 6-Thioxo-2-piperidone
The XLogP value of 0.6139 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Thioxo-2-piperidone. With a topological polar surface area (TPSA) of 29.1 Ų, 6-Thioxo-2-piperidone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Thioxo-2-piperidone has 1 hydrogen bond donor(s) and 2 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 6-Thioxo-2-piperidone?
The CAS number of 6-Thioxo-2-piperidone is 5693-95-8.
What is the molecular formula of 6-Thioxo-2-piperidone?
The molecular formula of 6-Thioxo-2-piperidone is C5H7NOS.
What is the molecular weight of 6-Thioxo-2-piperidone?
The molecular weight of 6-Thioxo-2-piperidone is 129.02 g/mol.
Where can I buy 6-Thioxo-2-piperidone?
You can request a quote for 6-Thioxo-2-piperidone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Thioxo-2-piperidone?
Yes, KEHONG BIO provides custom synthesis services for 6-Thioxo-2-piperidone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.