1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride
TL;DR: 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride (CAS 96732-15-9) is a chemical compound with molecular formula C13H18ClN3O and molecular weight 267.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium chloride
Also Known As: AF 521, 5-((Diethylamino)methyl)-3-phenyl-1,2,4-oxadiazole hydrochloride, 1,2,4-OXADIAZOLE, 5-((DIETHYLAMINO)METHYL)-3-PHENYL-, HYDROCHLORIDE, diethyl-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium chloride, AF 521, 5-((Diethylamino)methyl)-3-phenyl-1,2,4-oxadiazole hydrochloride, 1,2,4-OXADIAZOLE, 5-((DIETHYLAMINO)METHYL)-3-PHENYL-, HYDROCHLORIDE, AC1L1MDV, LS-99114, diethyl-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium chloride, 96732-15-9
| Molecular Formula | C13H18ClN3O |
|---|---|
| Molecular Weight | 267.11 g/mol |
| LogP | -1.83 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.11383 |
| Heavy Atoms | 18 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 96732-15-9 |
|---|---|
| SMILES | CC[NH+](CC)CC1=NC(=NO1)C2=CC=CC=C2.[Cl-] |
| InChIKey | OUBOOWFFUQGIDE-UHFFFAOYSA-N |
Product Overview
1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride (CAS 96732-15-9), with molecular formula C13H18ClN3O and molecular weight 267.11 g/mol. IUPAC: diethyl-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium chloride.
Chemical Property Profile of 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride
Property Insights of 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride
The XLogP value of -1.83 indicates that 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, 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, 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, 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 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride?
The CAS number of 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride is 96732-15-9.
What is the molecular formula of 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride?
The molecular formula of 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride is C13H18ClN3O.
What is the molecular weight of 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride?
The molecular weight of 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride is 267.11 g/mol.
Where can I buy 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride?
You can request a quote for 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Oxadiazole, 5-((diethylamino)methyl)-3-phenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.