3-(4-Bromophenyl)-1,2,4,5-tetrazine
TL;DR: 3-(4-Bromophenyl)-1,2,4,5-tetrazine (CAS 56107-99-4) is a chemical compound with molecular formula C8H5BrN4 and molecular weight 235.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)-1,2,4,5-tetrazine
Also Known As: 3-(4-bromophenyl)-1,2,4,5-tetrazine, 3-(4-bromophenyl)-1,2,4,5-tetraazine, 1,2,4,5-tetrazine, 3-(4-bromophenyl)-, InChI=1/C8H5BrN4/c9-7-3-1-6(2-4-7)8-12-10-5-11-13-8/h1-5
| Molecular Formula | C8H5BrN4 |
|---|---|
| Molecular Weight | 235.97 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.96976 |
| Heavy Atoms | 13 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 56107-99-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN=CN=N2)Br |
| InChIKey | MFLXHPDTBBNRPG-UHFFFAOYSA-N |
Product Overview
3-(4-Bromophenyl)-1,2,4,5-tetrazine (CAS 56107-99-4), with molecular formula C8H5BrN4 and molecular weight 235.97 g/mol. IUPAC: 3-(4-bromophenyl)-1,2,4,5-tetrazine.
Chemical Property Profile of 3-(4-Bromophenyl)-1,2,4,5-tetrazine
Property Insights of 3-(4-Bromophenyl)-1,2,4,5-tetrazine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Bromophenyl)-1,2,4,5-tetrazine. With a topological polar surface area (TPSA) of 51.6 Ų, 3-(4-Bromophenyl)-1,2,4,5-tetrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Bromophenyl)-1,2,4,5-tetrazine 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 3-(4-Bromophenyl)-1,2,4,5-tetrazine?
The CAS number of 3-(4-Bromophenyl)-1,2,4,5-tetrazine is 56107-99-4.
What is the molecular formula of 3-(4-Bromophenyl)-1,2,4,5-tetrazine?
The molecular formula of 3-(4-Bromophenyl)-1,2,4,5-tetrazine is C8H5BrN4.
What is the molecular weight of 3-(4-Bromophenyl)-1,2,4,5-tetrazine?
The molecular weight of 3-(4-Bromophenyl)-1,2,4,5-tetrazine is 235.97 g/mol.
Where can I buy 3-(4-Bromophenyl)-1,2,4,5-tetrazine?
You can request a quote for 3-(4-Bromophenyl)-1,2,4,5-tetrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Bromophenyl)-1,2,4,5-tetrazine?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Bromophenyl)-1,2,4,5-tetrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.