2,4,6-Tris(4-bromophenyl)pyrimidine
TL;DR: 2,4,6-Tris(4-bromophenyl)pyrimidine (CAS 399507-79-0) is a chemical compound with molecular formula C22H13Br3N2 and molecular weight 541.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-tris(4-bromophenyl)pyrimidine
Also Known As: 2,4,6-Tris(4-bromophenyl)pyrimidine, 2,4,6-Tri(4-bromophenyl)pyrimidine, 2,4,6-Tris(4-bromophenyl)pyrimidine #
| Molecular Formula | C22H13Br3N2 |
|---|---|
| Molecular Weight | 541.86 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 541.8629 |
| Heavy Atoms | 27 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 399507-79-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC(=NC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)Br |
| InChIKey | LXXQADRIIXEBHT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Tris(4-bromophenyl)pyrimidine (CAS 399507-79-0), with molecular formula C22H13Br3N2 and molecular weight 541.86 g/mol. IUPAC: 2,4,6-tris(4-bromophenyl)pyrimidine.
Chemical Property Profile of 2,4,6-Tris(4-bromophenyl)pyrimidine
Property Insights of 2,4,6-Tris(4-bromophenyl)pyrimidine
The XLogP value of 7.3 indicates that 2,4,6-Tris(4-bromophenyl)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.8 Ų, 2,4,6-Tris(4-bromophenyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Tris(4-bromophenyl)pyrimidine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,6-Tris(4-bromophenyl)pyrimidine?
The CAS number of 2,4,6-Tris(4-bromophenyl)pyrimidine is 399507-79-0.
What is the molecular formula of 2,4,6-Tris(4-bromophenyl)pyrimidine?
The molecular formula of 2,4,6-Tris(4-bromophenyl)pyrimidine is C22H13Br3N2.
What is the molecular weight of 2,4,6-Tris(4-bromophenyl)pyrimidine?
The molecular weight of 2,4,6-Tris(4-bromophenyl)pyrimidine is 541.86 g/mol.
Where can I buy 2,4,6-Tris(4-bromophenyl)pyrimidine?
You can request a quote for 2,4,6-Tris(4-bromophenyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Tris(4-bromophenyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Tris(4-bromophenyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.