Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-
TL;DR: Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- (CAS 91944-93-3) is a chemical compound with molecular formula C18H24ClNO3 and molecular weight 337.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[7-(2-chloro-4-methoxyphenoxy)heptyl]-3-methyl-1,2-oxazole
Also Known As: TFPAD, Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-, 5-[7-(2-chloro-4-methoxyphenoxy)heptyl]-3-methyl-1,2-oxazole, 5-(7-(2-Chloro-4-methoxyphenoxy)heptyl)-3-methylisoxazole, 5-[7-(2-chloro-4-methoxy-phenoxy)heptyl]-3-methyl-isoxazole
| Molecular Formula | C18H24ClNO3 |
|---|---|
| Molecular Weight | 337.14 g/mol |
| LogP | 5.21702 |
| Topological Polar Surface Area | 44.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 337.14447 |
| Heavy Atoms | 23 |
| Complexity | 597.7027 |
Chemical Identifiers
| CAS Number | 91944-93-3 |
|---|---|
| SMILES | CC1=NOC(=C1)CCCCCCCOC2=C(C=C(C=C2)OC)Cl |
Product Overview
Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- (CAS 91944-93-3), with molecular formula C18H24ClNO3 and molecular weight 337.14 g/mol. IUPAC: 5-[7-(2-chloro-4-methoxyphenoxy)heptyl]-3-methyl-1,2-oxazole.
Chemical Property Profile of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-
Property Insights of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-
The XLogP value of 5.21702 indicates that Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.49 Ų, Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-?
The CAS number of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- is 91944-93-3.
What is the molecular formula of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-?
The molecular formula of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- is C18H24ClNO3.
What is the molecular weight of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-?
The molecular weight of Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- is 337.14 g/mol.
Where can I buy Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-?
You can request a quote for Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Isoxazole, 5-(7-(2-chloro-4-methoxyphenoxy)heptyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.