N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide
TL;DR: N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide (CAS 708292-95-9) is a chemical compound with molecular formula C12H19N3O2S and molecular weight 269.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide
Also Known As: CBKinase1_007580, CBKinase1_019980, N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide, BRD-K70552900-001-01-9, 2-(4-{[(2-furylmethyl)amino]thioxomethyl}piperazinyl)ethan-1-ol
| Molecular Formula | C12H19N3O2S |
|---|---|
| Molecular Weight | 269.12 g/mol |
| LogP | 0.264 |
| Topological Polar Surface Area | 51.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.1198 |
| Heavy Atoms | 18 |
| Complexity | 361.40924 |
Chemical Identifiers
| CAS Number | 708292-95-9 |
|---|---|
| SMILES | C1CN(CCN1CCO)C(=S)NCC2=CC=CO2 |
Product Overview
N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide (CAS 708292-95-9), with molecular formula C12H19N3O2S and molecular weight 269.12 g/mol. IUPAC: N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide.
Chemical Property Profile of N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide
Property Insights of N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide
The XLogP value of 0.264 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide. With a topological polar surface area (TPSA) of 51.88 Ų, N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide has 2 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 N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide?
The CAS number of N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide is 708292-95-9.
What is the molecular formula of N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide?
The molecular formula of N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide is C12H19N3O2S.
What is the molecular weight of N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide?
The molecular weight of N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide is 269.12 g/mol.
Where can I buy N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide?
You can request a quote for N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)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 N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(furan-2-ylmethyl)-4-(2-hydroxyethyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.