![4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide structure](/static/products/895/895405-81-9.png)
4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide
TL;DR: 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide (CAS 895405-81-9) is a chemical compound with molecular formula C20H25N3O3S2 and molecular weight 419.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxyphenyl)sulfonyl-N-(2-phenylethyl)piperazine-1-carbothioamide
Also Known As: 4-(4-methoxyphenyl)sulfonyl-N-phenethylpiperazine-1-carbothioamide, 4-(4-methoxyphenyl)sulfonyl-N-(2-phenylethyl)piperazine-1-carbothioamide, 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide, 1-[(4-methoxyphenyl)sulfonyl]-4-{[(2-phenylethyl)amino]thioxomethyl}piperazine
| Molecular Formula | C20H25N3O3S2 |
|---|---|
| Molecular Weight | 419.13 g/mol |
| LogP | 2.1187 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 419.13373 |
| Heavy Atoms | 28 |
| Complexity | 878.67175 |
Chemical Identifiers
| CAS Number | 895405-81-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCC3=CC=CC=C3 |
Product Overview
4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide (CAS 895405-81-9), with molecular formula C20H25N3O3S2 and molecular weight 419.13 g/mol. IUPAC: 4-(4-methoxyphenyl)sulfonyl-N-(2-phenylethyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide
Property Insights of 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide
The XLogP value of 2.1187 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide. Following Lipinski's Rule of Five, 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)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-(2-phenylethyl)piperazine-1-carbothioamide?
The CAS number of 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide is 895405-81-9.
What is the molecular formula of 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide?
The molecular formula of 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide is C20H25N3O3S2.
What is the molecular weight of 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide?
The molecular weight of 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide is 419.13 g/mol.
Where can I buy 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide?
You can request a quote for 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)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-(2-phenylethyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-methoxyphenyl)sulfonyl]-N-(2-phenylethyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.