1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole
TL;DR: 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole (CAS 462069-94-9) is a chemical compound with molecular formula C11H14N4O and molecular weight 218.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyphenyl)-1-propan-2-yltetrazole
Also Known As: 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole, 5-(4-methoxyphenyl)-1-propan-2-yltetrazole, 1-isopropyl-5-(4-methoxyphenyl)-1H-tetrazole, 5-(4-methoxyphenyl)-1-(propan-2-yl)-1H-tetrazole, 4-methoxy-1-[1-(methylethyl)(1,2,3,4-tetraazol-5-yl)]benzene
| Molecular Formula | C11H14N4O |
|---|---|
| Molecular Weight | 218.12 g/mol |
| LogP | 1.9296 |
| Topological Polar Surface Area | 52.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.11676 |
| Heavy Atoms | 16 |
| Complexity | 461.09174 |
Chemical Identifiers
| CAS Number | 462069-94-9 |
|---|---|
| SMILES | CC(C)N1C(=NN=N1)C2=CC=C(C=C2)OC |
Product Overview
1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole (CAS 462069-94-9), with molecular formula C11H14N4O and molecular weight 218.12 g/mol. IUPAC: 5-(4-methoxyphenyl)-1-propan-2-yltetrazole.
Chemical Property Profile of 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole
Property Insights of 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole
The XLogP value of 1.9296 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole. With a topological polar surface area (TPSA) of 52.83 Ų, 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole has 0 hydrogen bond donor(s) and 4 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 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole?
The CAS number of 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole is 462069-94-9.
What is the molecular formula of 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole?
The molecular formula of 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole is C11H14N4O.
What is the molecular weight of 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole?
The molecular weight of 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole is 218.12 g/mol.
Where can I buy 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole?
You can request a quote for 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Isopropyl-5-(4-methoxy-phenyl)-1H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.