4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
TL;DR: 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide (CAS 708228-65-3) is a chemical compound with molecular formula C15H25N3O3S and molecular weight 327.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
Also Known As: 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide, 4-(tetrahydrofuran-2-ylcarbonyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide
| Molecular Formula | C15H25N3O3S |
|---|---|
| Molecular Weight | 327.16 g/mol |
| LogP | 0.3631 |
| Topological Polar Surface Area | 54.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.16165 |
| Heavy Atoms | 22 |
| Complexity | 400.83685 |
Chemical Identifiers
| CAS Number | 708228-65-3 |
|---|---|
| SMILES | C1CC(OC1)CNC(=S)N2CCN(CC2)C(=O)C3CCCO3 |
Product Overview
4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide (CAS 708228-65-3), with molecular formula C15H25N3O3S and molecular weight 327.16 g/mol. IUPAC: 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
Property Insights of 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
The XLogP value of 0.3631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide. With a topological polar surface area (TPSA) of 54.04 Ų, 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)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-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
The CAS number of 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide is 708228-65-3.
What is the molecular formula of 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
The molecular formula of 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide is C15H25N3O3S.
What is the molecular weight of 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
The molecular weight of 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide is 327.16 g/mol.
Where can I buy 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
You can request a quote for 4-(oxolane-2-carbonyl)-N-(oxolan-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-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(oxolane-2-carbonyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.