1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine
TL;DR: 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine (CAS 327074-73-7) is a chemical compound with molecular formula C24H23ClN2OS and molecular weight 422.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3-chlorophenyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanethione
Also Known As: BIM-0005423.P001, 1-{[4-(benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine, (4-(benzyloxy)phenyl)(4-(3-chlorophenyl)piperazin-1-yl)methanethione, [4-(3-chlorophenyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanethione, [4-(3-chlorophenyl)piperazinyl][4-(phenylmethoxy)phenyl]methane-1-thione
| Molecular Formula | C24H23ClN2OS |
|---|---|
| Molecular Weight | 422.12 g/mol |
| LogP | 5.4167 |
| Topological Polar Surface Area | 15.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.12195 |
| Heavy Atoms | 29 |
| Complexity | 954.1294 |
Chemical Identifiers
| CAS Number | 327074-73-7 |
|---|---|
| SMILES | C1CN(CCN1C2=CC(=CC=C2)Cl)C(=S)C3=CC=C(C=C3)OCC4=CC=CC=C4 |
Product Overview
1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine (CAS 327074-73-7), with molecular formula C24H23ClN2OS and molecular weight 422.12 g/mol. IUPAC: [4-(3-chlorophenyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanethione.
Chemical Property Profile of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine
Property Insights of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine
The XLogP value of 5.4167 indicates that 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.71 Ų, 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine?
The CAS number of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine is 327074-73-7.
What is the molecular formula of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine?
The molecular formula of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine is C24H23ClN2OS.
What is the molecular weight of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine?
The molecular weight of 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine is 422.12 g/mol.
Where can I buy 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine?
You can request a quote for 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-{[4-(Benzyloxy)phenyl]carbonothioyl}-4-(3-chlorophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.