5-(3,4-dimethoxybenzyl)-2H-tetrazole
TL;DR: 5-(3,4-dimethoxybenzyl)-2H-tetrazole (CAS 300390-91-4) is a chemical compound with molecular formula C10H12N4O2 and molecular weight 220.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3,4-dimethoxyphenyl)methyl]-2H-tetrazole
Also Known As: 5-(3,4-dimethoxybenzyl)-2H-tetrazole, 5-(3,4-dimethoxybenzyl)-1H-tetraazole, 5-(3,4-Dimethoxy-benzyl)-1H-tetrazole, 5-[(3,4-dimethoxyphenyl)methyl]-2H-tetrazole, BB 0238278
| Molecular Formula | C10H12N4O2 |
|---|---|
| Molecular Weight | 220.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.09602 |
| Heavy Atoms | 16 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 300390-91-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NNN=N2)OC |
| InChIKey | JXOSKEXCJPFKGR-UHFFFAOYSA-N |
Product Overview
5-(3,4-dimethoxybenzyl)-2H-tetrazole (CAS 300390-91-4), with molecular formula C10H12N4O2 and molecular weight 220.10 g/mol. IUPAC: 5-[(3,4-dimethoxyphenyl)methyl]-2H-tetrazole.
Chemical Property Profile of 5-(3,4-dimethoxybenzyl)-2H-tetrazole
Property Insights of 5-(3,4-dimethoxybenzyl)-2H-tetrazole
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3,4-dimethoxybenzyl)-2H-tetrazole. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3,4-dimethoxybenzyl)-2H-tetrazole. Following Lipinski's Rule of Five, 5-(3,4-dimethoxybenzyl)-2H-tetrazole 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 5-(3,4-dimethoxybenzyl)-2H-tetrazole?
The CAS number of 5-(3,4-dimethoxybenzyl)-2H-tetrazole is 300390-91-4.
What is the molecular formula of 5-(3,4-dimethoxybenzyl)-2H-tetrazole?
The molecular formula of 5-(3,4-dimethoxybenzyl)-2H-tetrazole is C10H12N4O2.
What is the molecular weight of 5-(3,4-dimethoxybenzyl)-2H-tetrazole?
The molecular weight of 5-(3,4-dimethoxybenzyl)-2H-tetrazole is 220.10 g/mol.
Where can I buy 5-(3,4-dimethoxybenzyl)-2H-tetrazole?
You can request a quote for 5-(3,4-dimethoxybenzyl)-2H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3,4-dimethoxybenzyl)-2H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,4-dimethoxybenzyl)-2H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.