Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-
TL;DR: Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- (CAS 78868-46-9) is a chemical compound with molecular formula C19H17NO4 and molecular weight 323.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]propanoic acid
Also Known As: 4-(5-(4-Methoxyphenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid, Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-, 2-[4-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]propanoic acid, 2-{4-[5-(4-Methoxyphenyl)-1,2-oxazol-3-yl]phenyl}propanoic acid, BRN 4530043
| Molecular Formula | C19H17NO4 |
|---|---|
| Molecular Weight | 323.12 g/mol |
| LogP | 4.2053 |
| Topological Polar Surface Area | 72.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.11575 |
| Heavy Atoms | 24 |
| Complexity | 834.5632 |
Chemical Identifiers
| CAS Number | 78868-46-9 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)C2=NOC(=C2)C3=CC=C(C=C3)OC)C(=O)O |
Product Overview
Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- (CAS 78868-46-9), with molecular formula C19H17NO4 and molecular weight 323.12 g/mol. IUPAC: 2-[4-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]phenyl]propanoic acid.
Chemical Property Profile of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-
Property Insights of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-
The XLogP value of 4.2053 indicates that Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-. Following Lipinski's Rule of Five, Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- 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 Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-?
The CAS number of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- is 78868-46-9.
What is the molecular formula of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-?
The molecular formula of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- is C19H17NO4.
What is the molecular weight of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-?
The molecular weight of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- is 323.12 g/mol.
Where can I buy Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-?
You can request a quote for Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-alpha-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.