1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-
TL;DR: 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- (CAS 890095-45-1) is a chemical compound with molecular formula C8H6BrClN4 and molecular weight 271.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-5-(chloromethyl)tetrazole
Also Known As: 1-(4-bromophenyl)-5-(chloromethyl)-1H-tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)tetrazole, 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-, 1-(4-Bromo-phenyl)-5-chloromethyl-1H-tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-1,2,3,4-tetraazole
| Molecular Formula | C8H6BrClN4 |
|---|---|
| Molecular Weight | 271.95 g/mol |
| LogP | 2.1636 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.94644 |
| Heavy Atoms | 14 |
| Complexity | 425.16125 |
Chemical Identifiers
| CAS Number | 890095-45-1 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=NN=N2)CCl)Br |
Product Overview
1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- (CAS 890095-45-1), with molecular formula C8H6BrClN4 and molecular weight 271.95 g/mol. IUPAC: 1-(4-bromophenyl)-5-(chloromethyl)tetrazole.
Chemical Property Profile of 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-
Property Insights of 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-
The XLogP value of 2.1636 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-. With a topological polar surface area (TPSA) of 43.6 Ų, 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- 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 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-?
The CAS number of 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- is 890095-45-1.
What is the molecular formula of 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-?
The molecular formula of 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- is C8H6BrClN4.
What is the molecular weight of 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-?
The molecular weight of 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- is 271.95 g/mol.
Where can I buy 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-?
You can request a quote for 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Tetrazole, 1-(4-bromophenyl)-5-(chloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.