RefChem:329356
TL;DR: RefChem:329356 (CAS 36363-02-7) is a chemical compound with molecular formula C23H34ClNO2 and molecular weight 391.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(9-hydroxy-9-methyl-2-bicyclo[3.3.1]nonanyl)-4-phenylpiperidin-1-ium-4-yl]ethanone chloride
Also Known As: Bicyclo(3.3.1)nonan-9-ol, 2-(4-acetyl-4-phenyl-1-piperidyl)-9-methyl-, hydrochloride, 2-(4-Acetyl-4-phenyl-1-piperidyl)-9-methyl-bicyclo(3.3.1)nonan-9-ol hydrochloride, Ethanone, 1-(1-(9-hydroxy-9-methylbicyclo(3.3.1)non-2-yl)-4-phenyl-4-piperidinyl)-, HCl, 1-[1-(9-Hydroxy-9-methyl-8-bicyclo[3.3.1]nonanyl)-4-phenylpiperidin-1-ium-4-yl]ethanone chloride, 1-[1-(9-hydroxy-9-methyl-4-bicyclo[3.3.1]nonanyl)-4-phenylpiperidin-1-ium-4-yl]ethanone chloride
| Molecular Formula | C23H34ClNO2 |
|---|---|
| Molecular Weight | 391.23 g/mol |
| LogP | -0.47 |
| Topological Polar Surface Area | 41.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.2278 |
| Heavy Atoms | 27 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 36363-02-7 |
|---|---|
| SMILES | CC(=O)C1(CC[NH+](CC1)C2CCC3CCCC2C3(C)O)C4=CC=CC=C4.[Cl-] |
| InChIKey | QJESHKDYIYDTMN-UHFFFAOYSA-N |
Product Overview
RefChem:329356 (CAS 36363-02-7), with molecular formula C23H34ClNO2 and molecular weight 391.23 g/mol. IUPAC: 1-[1-(9-hydroxy-9-methyl-2-bicyclo[3.3.1]nonanyl)-4-phenylpiperidin-1-ium-4-yl]ethanone chloride.
Chemical Property Profile of RefChem:329356
Property Insights of RefChem:329356
The XLogP value of -0.47 indicates that RefChem:329356 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.7 Ų, RefChem:329356 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:329356 has 2 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 RefChem:329356?
The CAS number of RefChem:329356 is 36363-02-7.
What is the molecular formula of RefChem:329356?
The molecular formula of RefChem:329356 is C23H34ClNO2.
What is the molecular weight of RefChem:329356?
The molecular weight of RefChem:329356 is 391.23 g/mol.
Where can I buy RefChem:329356?
You can request a quote for RefChem:329356 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:329356?
Yes, KEHONG BIO provides custom synthesis services for RefChem:329356 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.