4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide
TL;DR: 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide (CAS 775293-90-8) is a chemical compound with molecular formula C18H27N3OS and molecular weight 333.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(oxolan-2-ylmethyl)-4-(2-phenylethyl)piperazine-1-carbothioamide
Also Known As: 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide, N-(oxolan-2-ylmethyl)-4-phenethyl-piperazine-1-carbothioamide, N-(oxolan-2-ylmethyl)-4-phenethylpiperazine-1-carbothioamide, [(oxolan-2-ylmethyl)amino][4-(2-phenylethyl)piperazinyl]methane-1-thione, N-(OXOLAN-2-YLMETHYL)-4-(2-PHENYLETHYL)PIPERAZINE-1-CARBOTHIOAMIDE
| Molecular Formula | C18H27N3OS |
|---|---|
| Molecular Weight | 333.19 g/mol |
| LogP | 1.9002 |
| Topological Polar Surface Area | 27.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.18747 |
| Heavy Atoms | 23 |
| Complexity | 482.2999 |
Chemical Identifiers
| CAS Number | 775293-90-8 |
|---|---|
| SMILES | C1CC(OC1)CNC(=S)N2CCN(CC2)CCC3=CC=CC=C3 |
Product Overview
4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide (CAS 775293-90-8), with molecular formula C18H27N3OS and molecular weight 333.19 g/mol. IUPAC: N-(oxolan-2-ylmethyl)-4-(2-phenylethyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide
Property Insights of 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide
The XLogP value of 1.9002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide. With a topological polar surface area (TPSA) of 27.74 Ų, 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide has 1 hydrogen bond donor(s) and 3 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-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide?
The CAS number of 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide is 775293-90-8.
What is the molecular formula of 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide?
The molecular formula of 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide is C18H27N3OS.
What is the molecular weight of 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide?
The molecular weight of 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide is 333.19 g/mol.
Where can I buy 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide?
You can request a quote for 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)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-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-phenylethyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.