4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
TL;DR: 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide (CAS 708233-40-3) is a chemical compound with molecular formula C19H20F3N3O3S2 and molecular weight 459.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Also Known As: 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide, 1-[(4-methoxyphenyl)sulfonyl]-4-(thioxo{[3-(trifluoromethyl)phenyl]amino}methy l)piperazine, 4-[(4-methoxyphenyl)sulfonyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
| Molecular Formula | C19H20F3N3O3S2 |
|---|---|
| Molecular Weight | 459.09 g/mol |
| LogP | 3.4173 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 459.0898 |
| Heavy Atoms | 30 |
| Complexity | 1003.675 |
Chemical Identifiers
| CAS Number | 708233-40-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide (CAS 708233-40-3), with molecular formula C19H20F3N3O3S2 and molecular weight 459.09 g/mol. IUPAC: 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide.
Chemical Property Profile of 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
Property Insights of 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide
The XLogP value of 3.4173 indicates that 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide. Following Lipinski's Rule of Five, 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide 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-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
The CAS number of 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is 708233-40-3.
What is the molecular formula of 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
The molecular formula of 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is C19H20F3N3O3S2.
What is the molecular weight of 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
The molecular weight of 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide is 459.09 g/mol.
Where can I buy 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
You can request a quote for 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.