Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride
TL;DR: Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride (CAS 14716-73-5) is a chemical compound with molecular formula C14H18Cl2N2O and molecular weight 300.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl-diethylazanium chloride
Also Known As: 3-(p-Chlorophenyl)-5-(diethylaminomethyl)isoxazole hydrochloride, ISOXAZOLE, 3-(p-CHLOROPHENYL)-5-(DIETHYLAMINOMETHYL)-, HYDROCHLORIDE, [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl-diethylazanium chloride, Isoxazole, 3-(p-chlorophenyl)-5-[(diethylamino)methyl]-, monohydrochloride, RefChem:350210
| Molecular Formula | C14H18Cl2N2O |
|---|---|
| Molecular Weight | 300.08 g/mol |
| LogP | -0.58 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.07962 |
| Heavy Atoms | 19 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 14716-73-5 |
|---|---|
| SMILES | CC[NH+](CC)CC1=CC(=NO1)C2=CC=C(C=C2)Cl.[Cl-] |
| InChIKey | VYBFHFFWHMWJKC-UHFFFAOYSA-N |
Product Overview
Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride (CAS 14716-73-5), with molecular formula C14H18Cl2N2O and molecular weight 300.08 g/mol. IUPAC: [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl-diethylazanium chloride.
Chemical Property Profile of Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride
Property Insights of Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride
The XLogP value of -0.58 indicates that Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, 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-(diethylaminomethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, 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-(diethylaminomethyl)-, hydrochloride?
The CAS number of Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride is 14716-73-5.
What is the molecular formula of Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride?
The molecular formula of Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride is C14H18Cl2N2O.
What is the molecular weight of Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride?
The molecular weight of Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride is 300.08 g/mol.
Where can I buy Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride?
You can request a quote for Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, 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-(diethylaminomethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoxazole, 3-(p-chlorophenyl)-5-(diethylaminomethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.