![4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- structure](/static/products/9588/958818-89-8.webp)
4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-
TL;DR: 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- (CAS 958818-89-8) is a chemical compound with molecular formula C16H20N2O3 and molecular weight 288.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic acid
Also Known As: 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-, 4-Isoxazolecarboxylic acid, 5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-, 5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic acid, 5-methyl-3-[2-methylamino-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic Acid
| Molecular Formula | C16H20N2O3 |
|---|---|
| Molecular Weight | 288.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.1474 |
| Heavy Atoms | 21 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 958818-89-8 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC(=C2NC)CC(C)C)C(=O)O |
| InChIKey | JAUBDTZVXUZKFD-UHFFFAOYSA-N |
Product Overview
4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- (CAS 958818-89-8), with molecular formula C16H20N2O3 and molecular weight 288.15 g/mol. IUPAC: 5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic acid.
Chemical Property Profile of 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-
Property Insights of 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-
The XLogP value of 3.5 indicates that 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-. Following Lipinski's Rule of Five, 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- has 2 hydrogen bond donor(s) and 5 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 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-?
The CAS number of 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- is 958818-89-8.
What is the molecular formula of 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-?
The molecular formula of 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- is C16H20N2O3.
What is the molecular weight of 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-?
The molecular weight of 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- is 288.15 g/mol.
Where can I buy 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-?
You can request a quote for 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]-?
Yes, KEHONG BIO provides custom synthesis services for 4-Isoxazolecarboxylicacid,5-methyl-3-[2- -3- phenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.