![ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate structure](/static/products/917/91759-59-0.png)
ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate
TL;DR: ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate (CAS 91759-59-0) is a chemical compound with molecular formula C14H18N4O5 and molecular weight 322.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[5-(3,4,5-trimethoxyphenyl)tetrazol-2-yl]acetate
Also Known As: ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate, A3533/0149673, ethyl 2-[5-(3,4,5-trimethoxyphenyl)tetrazol-2-yl]acetate, [5-(3,4,5-Trimethoxyphenyl)tetrazol-2-yl]acetic acid, ethyl ester, ETHYL 2-[5-(3,4,5-TRIMETHOXYPHENYL)-2H-1,2,3,4-TETRAZOL-2-YL]ACETATE
| Molecular Formula | C14H18N4O5 |
|---|---|
| Molecular Weight | 322.13 g/mol |
| LogP | 0.929 |
| Topological Polar Surface Area | 97.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 322.12772 |
| Heavy Atoms | 23 |
| Complexity | 660.5523 |
Chemical Identifiers
| CAS Number | 91759-59-0 |
|---|---|
| SMILES | CCOC(=O)CN1N=C(N=N1)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate (CAS 91759-59-0), with molecular formula C14H18N4O5 and molecular weight 322.13 g/mol. IUPAC: ethyl 2-[5-(3,4,5-trimethoxyphenyl)tetrazol-2-yl]acetate.
Chemical Property Profile of ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate
Property Insights of ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate
The XLogP value of 0.929 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate. The TPSA of 97.59 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate. Following Lipinski's Rule of Five, ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate has 0 hydrogen bond donor(s) and 8 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-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate?
The CAS number of ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate is 91759-59-0.
What is the molecular formula of ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate?
The molecular formula of ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate is C14H18N4O5.
What is the molecular weight of ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate?
The molecular weight of ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate is 322.13 g/mol.
Where can I buy ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate?
You can request a quote for ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl [5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.