3-Piperidinethiol, 1-methyl-
TL;DR: 3-Piperidinethiol, 1-methyl- (CAS 98278-56-9) is a chemical compound with molecular formula C6H13NS and molecular weight 131.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylpiperidine-3-thiol
Also Known As: 1-methylpiperidine-3-thiol, 1-methyl-piperidine-3-thiol, 3-Piperidinethiol, 1-methyl-, 1-methyl-5-mercaptopiperidine, RefChem:281912
| Molecular Formula | C6H13NS |
|---|---|
| Molecular Weight | 131.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 4.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.07687 |
| Heavy Atoms | 8 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 98278-56-9 |
|---|---|
| SMILES | CN1CCCC(C1)S |
| InChIKey | XSNHICJZIUNEOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Piperidinethiol, 1-methyl- (CAS 98278-56-9), with molecular formula C6H13NS and molecular weight 131.08 g/mol. IUPAC: 1-methylpiperidine-3-thiol.
Chemical Property Profile of 3-Piperidinethiol, 1-methyl-
Property Insights of 3-Piperidinethiol, 1-methyl-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Piperidinethiol, 1-methyl-. With a topological polar surface area (TPSA) of 4.2 Ų, 3-Piperidinethiol, 1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Piperidinethiol, 1-methyl- 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 3-Piperidinethiol, 1-methyl-?
The CAS number of 3-Piperidinethiol, 1-methyl- is 98278-56-9.
What is the molecular formula of 3-Piperidinethiol, 1-methyl-?
The molecular formula of 3-Piperidinethiol, 1-methyl- is C6H13NS.
What is the molecular weight of 3-Piperidinethiol, 1-methyl-?
The molecular weight of 3-Piperidinethiol, 1-methyl- is 131.08 g/mol.
Where can I buy 3-Piperidinethiol, 1-methyl-?
You can request a quote for 3-Piperidinethiol, 1-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Piperidinethiol, 1-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Piperidinethiol, 1-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.