(4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione
TL;DR: (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione (CAS 840480-34-4) is a chemical compound with molecular formula C19H19F3N2O2S and molecular weight 396.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxy-3-methoxyphenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanethione
Also Known As: (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione, (4Z)-2-methoxy-4-[sulfanyl-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methylidene]cyclohexa-2,5-dien-1-one, 2-methoxy-4-[sulfanyl-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C19H19F3N2O2S |
|---|---|
| Molecular Weight | 396.11 g/mol |
| LogP | 3.9173 |
| Topological Polar Surface Area | 35.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.11194 |
| Heavy Atoms | 27 |
| Complexity | 833.94476 |
Chemical Identifiers
| CAS Number | 840480-34-4 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(=S)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)O |
Product Overview
(4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione (CAS 840480-34-4), with molecular formula C19H19F3N2O2S and molecular weight 396.11 g/mol. IUPAC: (4-hydroxy-3-methoxyphenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanethione.
Chemical Property Profile of (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione
Property Insights of (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione
The XLogP value of 3.9173 indicates that (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)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 35.94 Ų, (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione has 1 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-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione?
The CAS number of (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione is 840480-34-4.
What is the molecular formula of (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione?
The molecular formula of (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione is C19H19F3N2O2S.
What is the molecular weight of (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione?
The molecular weight of (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione is 396.11 g/mol.
Where can I buy (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione?
You can request a quote for (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)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-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (4-hydroxy-3-methoxyphenyl)(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.