(5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione
TL;DR: (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione (CAS 391890-75-8) is a chemical compound with molecular formula C22H22N2OS and molecular weight 362.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-methylphenyl)piperazin-1-yl]-(5-phenylfuran-2-yl)methanethione
Also Known As: (5-phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione, 1-(2-methylphenyl)-4-(5-phenylfuran-2-carbothioyl)piperazine, F0494-0158, [4-(2-methylphenyl)piperazin-1-yl]-(5-phenylfuran-2-yl)methanethione
| Molecular Formula | C22H22N2OS |
|---|---|
| Molecular Weight | 362.15 g/mol |
| LogP | 4.75272 |
| Topological Polar Surface Area | 19.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.1453 |
| Heavy Atoms | 26 |
| Complexity | 895.27045 |
Chemical Identifiers
| CAS Number | 391890-75-8 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CCN(CC2)C(=S)C3=CC=C(O3)C4=CC=CC=C4 |
Product Overview
(5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione (CAS 391890-75-8), with molecular formula C22H22N2OS and molecular weight 362.15 g/mol. IUPAC: [4-(2-methylphenyl)piperazin-1-yl]-(5-phenylfuran-2-yl)methanethione.
Chemical Property Profile of (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione
Property Insights of (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione
The XLogP value of 4.75272 indicates that (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.62 Ų, (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione has 0 hydrogen bond donor(s) and 3 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 (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione?
The CAS number of (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione is 391890-75-8.
What is the molecular formula of (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione?
The molecular formula of (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione is C22H22N2OS.
What is the molecular weight of (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione?
The molecular weight of (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione is 362.15 g/mol.
Where can I buy (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione?
You can request a quote for (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-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 (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (5-Phenylfuran-2-yl)(4-(o-tolyl)piperazin-1-yl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.