双己维林
TL;DR: 双己维林 (CAS 561-77-3) is a chemical compound with molecular formula C20H35NO2 and molecular weight 321.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双己维林
2-piperidin-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate
Also Known As: Dihexyverine, Dihexiverine, Dihexiverina, Spasmolevel, Metaspas
| Molecular Formula | C20H35NO2 |
|---|---|
| Molecular Weight | 321.27 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.26678 |
| Heavy Atoms | 23 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 561-77-3 |
|---|---|
| SMILES | C1CCC(CC1)C2(CCCCC2)C(=O)OCCN3CCCCC3 |
| InChIKey | MNSQDVCVWNXBFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双己维林 (CAS 561-77-3), with molecular formula C20H35NO2 and molecular weight 321.27 g/mol. IUPAC: 2-piperidin-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate.
Chemical Property Profile of 双己维林
Property Insights of 双己维林
The XLogP value of 5.6 indicates that 双己维林 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 双己维林 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 双己维林 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 双己维林?
The CAS number of 双己维林 is 561-77-3.
What is the molecular formula of 双己维林?
The molecular formula of 双己维林 is C20H35NO2.
What is the molecular weight of 双己维林?
The molecular weight of 双己维林 is 321.27 g/mol.
Where can I buy 双己维林?
You can request a quote for 双己维林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双己维林?
Yes, KEHONG BIO provides custom synthesis services for 双己维林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.