Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride
TL;DR: Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride (CAS 1215-23-2) is a chemical compound with molecular formula C14H19ClN2O and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium chloride
Also Known As: 3-(Diethylaminomethyl)-5-phenylisoxazole hydrochloride, diethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium chloride, ISOXAZOLE, 3-(DIETHYLAMINOMETHYL)-5-PHENYL-, HYDROCHLORIDE, diethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium, N-Ethyl-N-((5-phenylisoxazol-3-yl)methyl)ethanaminehydrochloride
| Molecular Formula | C14H19ClN2O |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | -1.23 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.1186 |
| Heavy Atoms | 18 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 1215-23-2 |
|---|---|
| SMILES | CC[NH+](CC)CC1=NOC(=C1)C2=CC=CC=C2.[Cl-] |
| InChIKey | YMFFVBWOXHRZLL-UHFFFAOYSA-N |
Product Overview
Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride (CAS 1215-23-2), with molecular formula C14H19ClN2O and molecular weight 266.12 g/mol. IUPAC: diethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium chloride.
Chemical Property Profile of Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride
Property Insights of Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride
The XLogP value of -1.23 indicates that Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, 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-(diethylaminomethyl)-5-phenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, 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-(diethylaminomethyl)-5-phenyl-, hydrochloride?
The CAS number of Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride is 1215-23-2.
What is the molecular formula of Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride?
The molecular formula of Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride is C14H19ClN2O.
What is the molecular weight of Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride?
The molecular weight of Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride is 266.12 g/mol.
Where can I buy Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride?
You can request a quote for Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, 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-(diethylaminomethyl)-5-phenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoxazole, 3-(diethylaminomethyl)-5-phenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.