(4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione
TL;DR: (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione (CAS 868153-17-7) is a chemical compound with molecular formula C18H20N2O3S2 and molecular weight 376.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(benzenesulfonyl)piperazin-1-yl]-(4-methoxyphenyl)methanethione
Also Known As: 1-(BENZENESULFONYL)-4-(4-METHOXYBENZENECARBOTHIOYL)PIPERAZINE, (4-methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione, F1728-0004, [4-(benzenesulfonyl)piperazin-1-yl]-(4-methoxyphenyl)methanethione
| Molecular Formula | C18H20N2O3S2 |
|---|---|
| Molecular Weight | 376.09 g/mol |
| LogP | 2.3772 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.09152 |
| Heavy Atoms | 25 |
| Complexity | 828.3847 |
Chemical Identifiers
| CAS Number | 868153-17-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
(4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione (CAS 868153-17-7), with molecular formula C18H20N2O3S2 and molecular weight 376.09 g/mol. IUPAC: [4-(benzenesulfonyl)piperazin-1-yl]-(4-methoxyphenyl)methanethione.
Chemical Property Profile of (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione
Property Insights of (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione
The XLogP value of 2.3772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione. With a topological polar surface area (TPSA) of 49.85 Ų, (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione has 0 hydrogen bond donor(s) and 4 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 (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione?
The CAS number of (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione is 868153-17-7.
What is the molecular formula of (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione?
The molecular formula of (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione is C18H20N2O3S2.
What is the molecular weight of (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione?
The molecular weight of (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione is 376.09 g/mol.
Where can I buy (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione?
You can request a quote for (4-Methoxyphenyl)(4-(phenylsulfonyl)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 (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (4-Methoxyphenyl)(4-(phenylsulfonyl)piperazin-1-yl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.