1-(4-Methylbenzenecarbothioyl)piperidine
TL;DR: 1-(4-Methylbenzenecarbothioyl)piperidine (CAS 3481-62-7) is a chemical compound with molecular formula C13H17NS and molecular weight 219.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)-piperidin-1-ylmethanethione
Also Known As: N-p-Thiotoluyl-piperidin, 1-(4-METHYLBENZENECARBOTHIOYL)PIPERIDINE, 1-(4-methylbenzothioyl)piperidine, 1-(4-Methylthiobenzoyl)piperidine, Piperidin-1-yl(p-tolyl)methanethione
| Molecular Formula | C13H17NS |
|---|---|
| Molecular Weight | 219.11 g/mol |
| LogP | 3.15642 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.10817 |
| Heavy Atoms | 15 |
| Complexity | 336.0585 |
Chemical Identifiers
| CAS Number | 3481-62-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=S)N2CCCCC2 |
Product Overview
1-(4-Methylbenzenecarbothioyl)piperidine (CAS 3481-62-7), with molecular formula C13H17NS and molecular weight 219.11 g/mol. IUPAC: (4-methylphenyl)-piperidin-1-ylmethanethione.
Chemical Property Profile of 1-(4-Methylbenzenecarbothioyl)piperidine
Property Insights of 1-(4-Methylbenzenecarbothioyl)piperidine
The XLogP value of 3.15642 indicates that 1-(4-Methylbenzenecarbothioyl)piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 1-(4-Methylbenzenecarbothioyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylbenzenecarbothioyl)piperidine has 0 hydrogen bond donor(s) and 1 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-(4-Methylbenzenecarbothioyl)piperidine?
The CAS number of 1-(4-Methylbenzenecarbothioyl)piperidine is 3481-62-7.
What is the molecular formula of 1-(4-Methylbenzenecarbothioyl)piperidine?
The molecular formula of 1-(4-Methylbenzenecarbothioyl)piperidine is C13H17NS.
What is the molecular weight of 1-(4-Methylbenzenecarbothioyl)piperidine?
The molecular weight of 1-(4-Methylbenzenecarbothioyl)piperidine is 219.11 g/mol.
Where can I buy 1-(4-Methylbenzenecarbothioyl)piperidine?
You can request a quote for 1-(4-Methylbenzenecarbothioyl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylbenzenecarbothioyl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylbenzenecarbothioyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.