3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine
TL;DR: 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine (CAS 94872-87-4) is a chemical compound with molecular formula C21H14BrN3 and molecular weight 387.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)-5,6-diphenyl-1,2,4-triazine
Also Known As: 3-(4-bromophenyl)-5,6-diphenyl-1,2,4-triazine, 668-284-4, RefChem:492748
| Molecular Formula | C21H14BrN3 |
|---|---|
| Molecular Weight | 387.04 g/mol |
| LogP | 5.6351 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.0371 |
| Heavy Atoms | 25 |
| Complexity | 984.53735 |
Chemical Identifiers
| CAS Number | 94872-87-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(N=NC(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4 |
Product Overview
3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine (CAS 94872-87-4), with molecular formula C21H14BrN3 and molecular weight 387.04 g/mol. IUPAC: 3-(4-bromophenyl)-5,6-diphenyl-1,2,4-triazine.
Chemical Property Profile of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine
Property Insights of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine
The XLogP value of 5.6351 indicates that 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.67 Ų, 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine?
The CAS number of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine is 94872-87-4.
What is the molecular formula of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine?
The molecular formula of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine is C21H14BrN3.
What is the molecular weight of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine?
The molecular weight of 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine is 387.04 g/mol.
Where can I buy 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine?
You can request a quote for 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine 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)-5,6-diphenyl-1,2,4-triazine?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Bromophenyl)-5,6-diphenyl-1,2,4-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.