![1-[(Butylthio)methyl]piperidine structure](/static/products/534/53497-49-7.png)
1-[(Butylthio)methyl]piperidine
TL;DR: 1-[(Butylthio)methyl]piperidine (CAS 53497-49-7) is a chemical compound with molecular formula C10H21NS and molecular weight 187.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(butylsulfanylmethyl)piperidine
Also Known As: 1-(butylsulfanylmethyl)piperidine, 1-(butylthiomethyl)-piperidine, 1-[(butylthio)methyl]piperidine, 1-[(butylsulfanyl)methyl]piperidine
| Molecular Formula | C10H21NS |
|---|---|
| Molecular Weight | 187.14 g/mol |
| LogP | 2.9631 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 187.13947 |
| Heavy Atoms | 12 |
| Complexity | 100.0117 |
Chemical Identifiers
| CAS Number | 53497-49-7 |
|---|---|
| SMILES | CCCCSCN1CCCCC1 |
Product Overview
1-[(Butylthio)methyl]piperidine (CAS 53497-49-7), with molecular formula C10H21NS and molecular weight 187.14 g/mol. IUPAC: 1-(butylsulfanylmethyl)piperidine.
Chemical Property Profile of 1-[(Butylthio)methyl]piperidine
Property Insights of 1-[(Butylthio)methyl]piperidine
The XLogP value of 2.9631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(Butylthio)methyl]piperidine. With a topological polar surface area (TPSA) of 3.24 Ų, 1-[(Butylthio)methyl]piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(Butylthio)methyl]piperidine has 0 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 1-[(Butylthio)methyl]piperidine?
The CAS number of 1-[(Butylthio)methyl]piperidine is 53497-49-7.
What is the molecular formula of 1-[(Butylthio)methyl]piperidine?
The molecular formula of 1-[(Butylthio)methyl]piperidine is C10H21NS.
What is the molecular weight of 1-[(Butylthio)methyl]piperidine?
The molecular weight of 1-[(Butylthio)methyl]piperidine is 187.14 g/mol.
Where can I buy 1-[(Butylthio)methyl]piperidine?
You can request a quote for 1-[(Butylthio)methyl]piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(Butylthio)methyl]piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(Butylthio)methyl]piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.