Furethidine
TL;DR: Furethidine (CAS 2385-81-1) is a chemical compound with molecular formula C21H31NO4 and molecular weight 361.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[2-(oxolan-2-ylmethoxy)ethyl]-4-phenylpiperidine-4-carboxylate
Also Known As: FURETHIDINE, Furethidinum, Furetidina, Furetidina [DCIT], Furethidinum [INN-Latin]
| Molecular Formula | C21H31NO4 |
|---|---|
| Molecular Weight | 361.23 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 361.2253 |
| Heavy Atoms | 26 |
| Complexity | 428.0 |
| Melting Point | 28 |
| Boiling Point | 210 |
Chemical Identifiers
| CAS Number | 2385-81-1 |
|---|---|
| SMILES | CCOC(=O)C1(CCN(CC1)CCOCC2CCCO2)C3=CC=CC=C3 |
| InChIKey | NNCOZXNZFLUYGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Furethidine (CAS 2385-81-1), with molecular formula C21H31NO4 and molecular weight 361.23 g/mol. IUPAC: ethyl 1-[2-(oxolan-2-ylmethoxy)ethyl]-4-phenylpiperidine-4-carboxylate.
Chemical Property Profile of Furethidine
Property Insights of Furethidine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Furethidine. With a topological polar surface area (TPSA) of 48.0 Ų, Furethidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Furethidine has 0 hydrogen bond donor(s) and 5 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 Furethidine?
The CAS number of Furethidine is 2385-81-1.
What is the molecular formula of Furethidine?
The molecular formula of Furethidine is C21H31NO4.
What is the molecular weight of Furethidine?
The molecular weight of Furethidine is 361.23 g/mol.
Where can I buy Furethidine?
You can request a quote for Furethidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furethidine?
Yes, KEHONG BIO provides custom synthesis services for Furethidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.