(2-Methoxyphenyl)(piperidin-1-yl)methanethione
TL;DR: (2-Methoxyphenyl)(piperidin-1-yl)methanethione (CAS 5843-39-0) is a chemical compound with molecular formula C13H17NOS and molecular weight 235.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxyphenyl)-piperidin-1-ylmethanethione
Also Known As: o-Methoxythiobenzopiperidide, (2-methoxyphenyl)(piperidin-1-yl)methanethione, KST-1A6233, 1-(2-methoxybenzothioyl)piperidine, (2-methoxyphenyl)-(1-piperidyl)methanethione
| Molecular Formula | C13H17NOS |
|---|---|
| Molecular Weight | 235.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 44.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.10309 |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 5843-39-0 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=S)N2CCCCC2 |
| InChIKey | ZAGJGXGBOJSVGE-UHFFFAOYSA-N |
Product Overview
(2-Methoxyphenyl)(piperidin-1-yl)methanethione (CAS 5843-39-0), with molecular formula C13H17NOS and molecular weight 235.10 g/mol. IUPAC: (2-methoxyphenyl)-piperidin-1-ylmethanethione.
Chemical Property Profile of (2-Methoxyphenyl)(piperidin-1-yl)methanethione
Property Insights of (2-Methoxyphenyl)(piperidin-1-yl)methanethione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Methoxyphenyl)(piperidin-1-yl)methanethione. With a topological polar surface area (TPSA) of 44.6 Ų, (2-Methoxyphenyl)(piperidin-1-yl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Methoxyphenyl)(piperidin-1-yl)methanethione 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 (2-Methoxyphenyl)(piperidin-1-yl)methanethione?
The CAS number of (2-Methoxyphenyl)(piperidin-1-yl)methanethione is 5843-39-0.
What is the molecular formula of (2-Methoxyphenyl)(piperidin-1-yl)methanethione?
The molecular formula of (2-Methoxyphenyl)(piperidin-1-yl)methanethione is C13H17NOS.
What is the molecular weight of (2-Methoxyphenyl)(piperidin-1-yl)methanethione?
The molecular weight of (2-Methoxyphenyl)(piperidin-1-yl)methanethione is 235.10 g/mol.
Where can I buy (2-Methoxyphenyl)(piperidin-1-yl)methanethione?
You can request a quote for (2-Methoxyphenyl)(piperidin-1-yl)methanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Methoxyphenyl)(piperidin-1-yl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (2-Methoxyphenyl)(piperidin-1-yl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.