4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester
TL;DR: 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester (CAS 53872-17-6) is a chemical compound with molecular formula C13H13NO4 and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-methoxy-2-(4-methylphenyl)-1,3-oxazole-4-carboxylate
Also Known As: Methyl 5-methoxy-2-(p-tolyl)oxazole-4-carboxylate, Methyl 5-methoxy-2-(4-methylphenyl)-1,3-oxazole-4-carboxylate, 4-Carbomethoxy-5-methoxy-2-(4'-methylphenyl)oxazole, 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester, 5-methoxy-2-p-tolyl-oxazole-4-carboxylic acid methyl ester
| Molecular Formula | C13H13NO4 |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 2.44522 |
| Topological Polar Surface Area | 61.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.08446 |
| Heavy Atoms | 18 |
| Complexity | 556.87024 |
Chemical Identifiers
| CAS Number | 53872-17-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(O2)OC)C(=O)OC |
Product Overview
4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester (CAS 53872-17-6), with molecular formula C13H13NO4 and molecular weight 247.08 g/mol. IUPAC: methyl 5-methoxy-2-(4-methylphenyl)-1,3-oxazole-4-carboxylate.
Chemical Property Profile of 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester
Property Insights of 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester
The XLogP value of 2.44522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester. The TPSA of 61.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester. Following Lipinski's Rule of Five, 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester has 0 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-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester?
The CAS number of 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester is 53872-17-6.
What is the molecular formula of 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester?
The molecular formula of 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester is C13H13NO4.
What is the molecular weight of 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester?
The molecular weight of 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester is 247.08 g/mol.
Where can I buy 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester?
You can request a quote for 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxazolecarboxylic acid, 5-methoxy-2-(4-methylphenyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.