5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate
TL;DR: 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate (CAS 304693-69-4) is a chemical compound with molecular formula C14H15NO6 and molecular weight 293.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-1,2-oxazol-3-yl) 3,4,5-trimethoxybenzoate
Also Known As: 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate, 5-methyl-1,2-oxazol-3-yl 3,4,5-trimethoxybenzoate, (5-methyl-1,2-oxazol-3-yl) 3,4,5-trimethoxybenzoate
| Molecular Formula | C14H15NO6 |
|---|---|
| Molecular Weight | 293.09 g/mol |
| LogP | 2.22802 |
| Topological Polar Surface Area | 80.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.08994 |
| Heavy Atoms | 21 |
| Complexity | 623.65894 |
Chemical Identifiers
| CAS Number | 304693-69-4 |
|---|---|
| SMILES | CC1=CC(=NO1)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate (CAS 304693-69-4), with molecular formula C14H15NO6 and molecular weight 293.09 g/mol. IUPAC: (5-methyl-1,2-oxazol-3-yl) 3,4,5-trimethoxybenzoate.
Chemical Property Profile of 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate
Property Insights of 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate
The XLogP value of 2.22802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate. The TPSA of 80.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate has 0 hydrogen bond donor(s) and 7 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 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate?
The CAS number of 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate is 304693-69-4.
What is the molecular formula of 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate?
The molecular formula of 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate is C14H15NO6.
What is the molecular weight of 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate?
The molecular weight of 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate is 293.09 g/mol.
Where can I buy 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate?
You can request a quote for 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-3-isoxazolyl 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.