(4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione structure

(4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione

TL;DR: (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione (CAS 877818-41-2) is a chemical compound with molecular formula C19H19FN2OS2 and molecular weight 374.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

[4-(4-fluorobenzenecarbothioyl)piperazin-1-yl]-(4-methoxyphenyl)methanethione

Also Known As: VU0507351-1, 1-(4-fluorobenzenecarbothioyl)-4-(4-methoxybenzenecarbothioyl)piperazine, F3005-0014, (4-fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione, [4-(4-fluorobenzenecarbothioyl)piperazin-1-yl]-(4-methoxyphenyl)methanethione

CAS: 877818-41-2
Molecular Formula C19H19FN2OS2
Molecular Weight 374.09 g/mol
LogP 3.5031
Topological Polar Surface Area 15.71 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 374.0923
Heavy Atoms 25
Complexity 753.9985

Chemical Identifiers

CAS Number 877818-41-2
SMILES COC1=CC=C(C=C1)C(=S)N2CCN(CC2)C(=S)C3=CC=C(C=C3)F

Product Overview

(4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione (CAS 877818-41-2), with molecular formula C19H19FN2OS2 and molecular weight 374.09 g/mol. IUPAC: [4-(4-fluorobenzenecarbothioyl)piperazin-1-yl]-(4-methoxyphenyl)methanethione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione

XLogP
3.5031
TPSA (Topological Polar Surface Area)
15.71
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
3
Heavy Atoms
25
Complexity
753.9985
Exact Mass
374.0923
Monoisotopic Mass
374.0923
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione

The XLogP value of 3.5031 indicates that (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)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 15.71 Ų, (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione?

The CAS number of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione is 877818-41-2.

What is the molecular formula of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione?

The molecular formula of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione is C19H19FN2OS2.

What is the molecular weight of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione?

The molecular weight of (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione is 374.09 g/mol.

Where can I buy (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione?

You can request a quote for (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)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-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione?

Yes, KEHONG BIO provides custom synthesis services for (4-Fluorophenyl)(4-(4-methoxyphenylcarbonothioyl)piperazin-1-yl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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