Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate
TL;DR: Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate (CAS 205115-25-9) is a chemical compound with molecular formula C18H15NO4 and molecular weight 309.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-benzhydryloxy-1,2-oxazole-5-carboxylate
Also Known As: Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate, Methyl 3-benzhydryloxy-1,2-oxazole-5-carboxylate, Methyl 3-(diphenylmethoxy)-1,2-oxazole-5-carboxylate, InChI=1/C18H15NO4/c1-21-18(20)15-12-16(19-23-15)22-17(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,17H,1H
| Molecular Formula | C18H15NO4 |
|---|---|
| Molecular Weight | 309.10 g/mol |
| LogP | 3.6296 |
| Topological Polar Surface Area | 61.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.1001 |
| Heavy Atoms | 23 |
| Complexity | 728.4853 |
Chemical Identifiers
| CAS Number | 205115-25-9 |
|---|---|
| SMILES | COC(=O)C1=CC(=NO1)OC(C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate (CAS 205115-25-9), with molecular formula C18H15NO4 and molecular weight 309.10 g/mol. IUPAC: methyl 3-benzhydryloxy-1,2-oxazole-5-carboxylate.
Chemical Property Profile of Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate
Property Insights of Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate
The XLogP value of 3.6296 indicates that Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate. Following Lipinski's Rule of Five, Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate 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 Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate?
The CAS number of Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate is 205115-25-9.
What is the molecular formula of Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate?
The molecular formula of Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate is C18H15NO4.
What is the molecular weight of Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate?
The molecular weight of Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate is 309.10 g/mol.
Where can I buy Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate?
You can request a quote for Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(diphenylmethoxy)-5-isoxazolecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.