![4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid structure](/static/products/887/887679-11-0.png)
4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid
TL;DR: 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid (CAS 887679-11-0) is a chemical compound with molecular formula C11H12N2O4 and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,2-oxazole-3-carboxylic acid
Also Known As: ASN 13473793, 4-(3,5-Dimethyl-isoxazol-4-ylmethyl)-5-methyl-isoxazole-3-carboxylic acid, 4-[(3,5-dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid, 4-((3,5-Dimethylisoxazol-4-yl)methyl)-5-methylisoxazole-3-carboxylic acid, 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,2-oxazole-3-carboxylic acid
| Molecular Formula | C11H12N2O4 |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 1.87686 |
| Topological Polar Surface Area | 89.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.07971 |
| Heavy Atoms | 17 |
| Complexity | 548.53357 |
Chemical Identifiers
| CAS Number | 887679-11-0 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)CC2=C(ON=C2C(=O)O)C |
Product Overview
4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid (CAS 887679-11-0), with molecular formula C11H12N2O4 and molecular weight 236.08 g/mol. IUPAC: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,2-oxazole-3-carboxylic acid.
Chemical Property Profile of 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid
Property Insights of 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid
The XLogP value of 1.87686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid. The TPSA of 89.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid. Following Lipinski's Rule of Five, 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid has 1 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-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid?
The CAS number of 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid is 887679-11-0.
What is the molecular formula of 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid?
The molecular formula of 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid is C11H12N2O4.
What is the molecular weight of 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid?
The molecular weight of 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid is 236.08 g/mol.
Where can I buy 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid?
You can request a quote for 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,5-Dimethylisoxazol-4-yl)methyl]-5-methylisoxazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.