RefChem:1075711
TL;DR: RefChem:1075711 (CAS 102585-56-8) is a chemical compound with molecular formula C20H30ClNO3 and molecular weight 367.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ium-1-ylethyl 2-(1-hydroxycyclopentyl)-2-phenylacetate chloride
Also Known As: 2-(1-Piperidyl)ethyl (1-hydroxycyclopentyl)phenylacetate hydrochloride, Acetic acid, 2-(1-hydroxycyclopentyl)-2-phenyl-, 2-piperidinoethyl ester, hydrochloride, 1-(2-{[(1-hydroxycyclopentyl)(phenyl)acetyl]oxy}ethyl)piperidinium chloride, 2-piperidin-1-ium-1-ylethyl 2-(1-hydroxycyclopentyl)-2-phenylacetate chloride, RefChem:1075711
| Molecular Formula | C20H30ClNO3 |
|---|---|
| Molecular Weight | 367.19 g/mol |
| LogP | -1.31 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.1914 |
| Heavy Atoms | 25 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 102585-56-8 |
|---|---|
| SMILES | C1CC[NH+](CC1)CCOC(=O)C(C2=CC=CC=C2)C3(CCCC3)O.[Cl-] |
| InChIKey | ZHCPHZLOXBCRAR-UHFFFAOYSA-N |
Product Overview
RefChem:1075711 (CAS 102585-56-8), with molecular formula C20H30ClNO3 and molecular weight 367.19 g/mol. IUPAC: 2-piperidin-1-ium-1-ylethyl 2-(1-hydroxycyclopentyl)-2-phenylacetate chloride.
Chemical Property Profile of RefChem:1075711
Property Insights of RefChem:1075711
The XLogP value of -1.31 indicates that RefChem:1075711 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.0 Ų, RefChem:1075711 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1075711 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 RefChem:1075711?
The CAS number of RefChem:1075711 is 102585-56-8.
What is the molecular formula of RefChem:1075711?
The molecular formula of RefChem:1075711 is C20H30ClNO3.
What is the molecular weight of RefChem:1075711?
The molecular weight of RefChem:1075711 is 367.19 g/mol.
Where can I buy RefChem:1075711?
You can request a quote for RefChem:1075711 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075711?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075711 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.