1-(2-Phenylethanethioyl)piperidine
TL;DR: 1-(2-Phenylethanethioyl)piperidine (CAS 24815-46-1) 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.
2-phenyl-1-piperidin-1-ylethanethione
Also Known As: 2-Phenyl-1-(piperidin-1-yl)ethanethione, 1-(2-phenylethanethioyl)piperidine, 2-phenyl-1-piperidin-1-ylethanethione, N-(phenylthioacetyl)piperidine, 1-(Phenylthioacetyl)piperidine
| Molecular Formula | C13H17NS |
|---|---|
| Molecular Weight | 219.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.10817 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 24815-46-1 |
|---|---|
| SMILES | C1CCN(CC1)C(=S)CC2=CC=CC=C2 |
| InChIKey | ABZXDLGKAKJSIZ-UHFFFAOYSA-N |
Product Overview
1-(2-Phenylethanethioyl)piperidine (CAS 24815-46-1), with molecular formula C13H17NS and molecular weight 219.11 g/mol. IUPAC: 2-phenyl-1-piperidin-1-ylethanethione.
Chemical Property Profile of 1-(2-Phenylethanethioyl)piperidine
Property Insights of 1-(2-Phenylethanethioyl)piperidine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Phenylethanethioyl)piperidine. With a topological polar surface area (TPSA) of 35.3 Ų, 1-(2-Phenylethanethioyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Phenylethanethioyl)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-(2-Phenylethanethioyl)piperidine?
The CAS number of 1-(2-Phenylethanethioyl)piperidine is 24815-46-1.
What is the molecular formula of 1-(2-Phenylethanethioyl)piperidine?
The molecular formula of 1-(2-Phenylethanethioyl)piperidine is C13H17NS.
What is the molecular weight of 1-(2-Phenylethanethioyl)piperidine?
The molecular weight of 1-(2-Phenylethanethioyl)piperidine is 219.11 g/mol.
Where can I buy 1-(2-Phenylethanethioyl)piperidine?
You can request a quote for 1-(2-Phenylethanethioyl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Phenylethanethioyl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Phenylethanethioyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.