Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate
TL;DR: Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate (CAS 900306-35-6) is a chemical compound with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(2-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxylate
Also Known As: ChemDiv3_015364, ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate, ethyl 5-[(2-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxylate
| Molecular Formula | C13H14N2O4 |
|---|---|
| Molecular Weight | 262.10 g/mol |
| LogP | 1.8457 |
| Topological Polar Surface Area | 74.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.09537 |
| Heavy Atoms | 19 |
| Complexity | 565.2758 |
Chemical Identifiers
| CAS Number | 900306-35-6 |
|---|---|
| SMILES | CCOC(=O)C1=NN=C(O1)CC2=CC=CC=C2OC |
Product Overview
Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate (CAS 900306-35-6), with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol. IUPAC: ethyl 5-[(2-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxylate.
Chemical Property Profile of Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate
Property Insights of Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate
The XLogP value of 1.8457 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate. The TPSA of 74.45 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate has 0 hydrogen bond donor(s) and 6 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 Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate?
The CAS number of Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate is 900306-35-6.
What is the molecular formula of Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate?
The molecular formula of Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate is C13H14N2O4.
What is the molecular weight of Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate?
The molecular weight of Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate is 262.10 g/mol.
Where can I buy Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate?
You can request a quote for Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-(2-methoxybenzyl)-1,3,4-oxadiazole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.