Butylthiopiperidine
TL;DR: Butylthiopiperidine (CAS 25116-56-7) is a chemical compound with molecular formula C9H19NS and molecular weight 173.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butylsulfanylpiperidine
Also Known As: butylthiopiperidine, 1-butylsulfanylpiperidine, 1-(BUTYLSULFANYL)PIPERIDINE
| Molecular Formula | C9H19NS |
|---|---|
| Molecular Weight | 173.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 173.12383 |
| Heavy Atoms | 11 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 25116-56-7 |
|---|---|
| SMILES | CCCCSN1CCCCC1 |
| InChIKey | IUJOVGYPCHBXBQ-UHFFFAOYSA-N |
Product Overview
Butylthiopiperidine (CAS 25116-56-7), with molecular formula C9H19NS and molecular weight 173.12 g/mol. IUPAC: 1-butylsulfanylpiperidine.
Chemical Property Profile of Butylthiopiperidine
Property Insights of Butylthiopiperidine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butylthiopiperidine. With a topological polar surface area (TPSA) of 28.5 Ų, Butylthiopiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butylthiopiperidine 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 Butylthiopiperidine?
The CAS number of Butylthiopiperidine is 25116-56-7.
What is the molecular formula of Butylthiopiperidine?
The molecular formula of Butylthiopiperidine is C9H19NS.
What is the molecular weight of Butylthiopiperidine?
The molecular weight of Butylthiopiperidine is 173.12 g/mol.
Where can I buy Butylthiopiperidine?
You can request a quote for Butylthiopiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butylthiopiperidine?
Yes, KEHONG BIO provides custom synthesis services for Butylthiopiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.