Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride
TL;DR: Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride (CAS 6076-04-6) is a chemical compound with molecular formula C13H16Cl2N2O and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]ethyl-dimethylazanium chloride
Also Known As: 3-(p-Chlorophenyl)-5-(2-(dimethylamino)ethyl)isoxazole hydrochloride, 2-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]ethyl-dimethylazanium chloride, ISOXAZOLE, 3-(p-CHLOROPHENYL)-5-(2-(DIMETHYLAMINO)ETHYL)-, HYDROCHLORIDE, RefChem:350208
| Molecular Formula | C13H16Cl2N2O |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | -1.31 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.06396 |
| Heavy Atoms | 18 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 6076-04-6 |
|---|---|
| SMILES | C[NH+](C)CCC1=CC(=NO1)C2=CC=C(C=C2)Cl.[Cl-] |
| InChIKey | JSXKORXAQASWID-UHFFFAOYSA-N |
Product Overview
Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride (CAS 6076-04-6), with molecular formula C13H16Cl2N2O and molecular weight 286.06 g/mol. IUPAC: 2-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]ethyl-dimethylazanium chloride.
Chemical Property Profile of Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride
Property Insights of Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride
The XLogP value of -1.31 indicates that Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.5 Ų, Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride 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 Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride?
The CAS number of Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride is 6076-04-6.
What is the molecular formula of Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride?
The molecular formula of Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride is C13H16Cl2N2O.
What is the molecular weight of Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride?
The molecular weight of Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride is 286.06 g/mol.
Where can I buy Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride?
You can request a quote for Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoxazole, 3-(p-chlorophenyl)-5-(2-(dimethylamino)ethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.