2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride
TL;DR: 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride (CAS 5588-25-0) is a chemical compound with molecular formula C20H36ClNO2 and molecular weight 357.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate chloride
Also Known As: Neospasmina, Diverine, Olimplex, Seclin, Spasmodex
| Molecular Formula | C20H36ClNO2 |
|---|---|
| Molecular Weight | 357.24 g/mol |
| LogP | 0.13 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.24347 |
| Heavy Atoms | 24 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 5588-25-0 |
|---|---|
| SMILES | C1CCC(CC1)C2(CCCCC2)C(=O)OCC[NH+]3CCCCC3.[Cl-] |
| InChIKey | AQFATCCHOXBYNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride (CAS 5588-25-0), with molecular formula C20H36ClNO2 and molecular weight 357.24 g/mol. IUPAC: 2-piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate chloride.
Chemical Property Profile of 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride
Property Insights of 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride
The XLogP value of 0.13 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride. With a topological polar surface area (TPSA) of 30.7 Ų, 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride 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 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride?
The CAS number of 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride is 5588-25-0.
What is the molecular formula of 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride?
The molecular formula of 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride is C20H36ClNO2.
What is the molecular weight of 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride?
The molecular weight of 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride is 357.24 g/mol.
Where can I buy 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride?
You can request a quote for 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Piperidin-1-ium-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.