1-(4-bromophenyl)-1H-tetrazole
TL;DR: 1-(4-bromophenyl)-1H-tetrazole (CAS 57058-01-2) is a chemical compound with molecular formula C7H5BrN4 and molecular weight 223.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)tetrazole
Also Known As: 1-(4-bromophenyl)-1H-tetrazole, 1-(4-bromophenyl)tetrazole, 1- -1H-tetrazol, 1-(4-Bromo-Phenyl)-1H-tetrazol, 1H-Tetrazole, 1-(4-bromophenyl)-
| Molecular Formula | C7H5BrN4 |
|---|---|
| Molecular Weight | 223.97 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.96976 |
| Heavy Atoms | 12 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 57058-01-2 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C=NN=N2)Br |
| InChIKey | SFMSAALWEDCZFB-UHFFFAOYSA-N |
Product Overview
1-(4-bromophenyl)-1H-tetrazole (CAS 57058-01-2), with molecular formula C7H5BrN4 and molecular weight 223.97 g/mol. IUPAC: 1-(4-bromophenyl)tetrazole.
Chemical Property Profile of 1-(4-bromophenyl)-1H-tetrazole
Property Insights of 1-(4-bromophenyl)-1H-tetrazole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-bromophenyl)-1H-tetrazole. With a topological polar surface area (TPSA) of 43.6 Ų, 1-(4-bromophenyl)-1H-tetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-bromophenyl)-1H-tetrazole has 0 hydrogen bond donor(s) and 3 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-(4-bromophenyl)-1H-tetrazole?
The CAS number of 1-(4-bromophenyl)-1H-tetrazole is 57058-01-2.
What is the molecular formula of 1-(4-bromophenyl)-1H-tetrazole?
The molecular formula of 1-(4-bromophenyl)-1H-tetrazole is C7H5BrN4.
What is the molecular weight of 1-(4-bromophenyl)-1H-tetrazole?
The molecular weight of 1-(4-bromophenyl)-1H-tetrazole is 223.97 g/mol.
Where can I buy 1-(4-bromophenyl)-1H-tetrazole?
You can request a quote for 1-(4-bromophenyl)-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-(4-bromophenyl)-1H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-bromophenyl)-1H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.