Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride
TL;DR: Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride (CAS 2148-68-7) is a chemical compound with molecular formula C15H20ClN3O and molecular weight 293.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-2-yl-1,2-oxazole chloride
Also Known As: 3-(2-Pyridyl)-5-(2-piperidinoethyl)-isoxazole hydrochloride, 5-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-2-yl-1,2-oxazole chloride, ISOXAZOLE, 5-(2-PIPERIDINOETHYL)-3-(2-PYRIDYL)-, HYDROCHLORIDE, RefChem:350244
| Molecular Formula | C15H20ClN3O |
|---|---|
| Molecular Weight | 293.13 g/mol |
| LogP | -1.65 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.1295 |
| Heavy Atoms | 20 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 2148-68-7 |
|---|---|
| SMILES | C1CC[NH+](CC1)CCC2=CC(=NO2)C3=CC=CC=N3.[Cl-] |
| InChIKey | ROSWHGYZHKEBCH-UHFFFAOYSA-N |
Product Overview
Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride (CAS 2148-68-7), with molecular formula C15H20ClN3O and molecular weight 293.13 g/mol. IUPAC: 5-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-2-yl-1,2-oxazole chloride.
Chemical Property Profile of Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride
Property Insights of Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride
The XLogP value of -1.65 indicates that Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.4 Ų, Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride has 1 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 Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride?
The CAS number of Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride is 2148-68-7.
What is the molecular formula of Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride?
The molecular formula of Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride is C15H20ClN3O.
What is the molecular weight of Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride?
The molecular weight of Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride is 293.13 g/mol.
Where can I buy Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride?
You can request a quote for Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoxazole, 5-(2-piperidinoethyl)-3-(2-pyridyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.