(4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione
TL;DR: (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione (CAS 460993-12-8) is a chemical compound with molecular formula C18H20FN3S and molecular weight 329.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-fluorophenyl)-N-(4-methylphenyl)piperazine-1-carbothioamide
Also Known As: starbld0024264, (4-(2-FLUOROPHENYL)PIPERAZINYL)((4-METHYLPHENYL)AMINO)METHANE-1-THIONE, 4-(2-fluorophenyl)-N-(4-methylphenyl)piperazine-1-carbothioamide, BAS 04935880, 4-(2-Fluorophenyl)-N-(p-tolyl)piperazine-1-carbothioamide
| Molecular Formula | C18H20FN3S |
|---|---|
| Molecular Weight | 329.14 g/mol |
| LogP | 3.65312 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 329.1362 |
| Heavy Atoms | 23 |
| Complexity | 678.92096 |
Chemical Identifiers
| CAS Number | 460993-12-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC=C3F |
Product Overview
(4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione (CAS 460993-12-8), with molecular formula C18H20FN3S and molecular weight 329.14 g/mol. IUPAC: 4-(2-fluorophenyl)-N-(4-methylphenyl)piperazine-1-carbothioamide.
Chemical Property Profile of (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione
Property Insights of (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione
The XLogP value of 3.65312 indicates that (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.51 Ų, (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione has 1 hydrogen bond donor(s) and 2 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-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione?
The CAS number of (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione is 460993-12-8.
What is the molecular formula of (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione?
The molecular formula of (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione is C18H20FN3S.
What is the molecular weight of (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione?
The molecular weight of (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione is 329.14 g/mol.
Where can I buy (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione?
You can request a quote for (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione?
Yes, KEHONG BIO provides custom synthesis services for (4-(2-Fluorophenyl)piperazinyl)((4-methylphenyl)amino)methane-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.