2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine
TL;DR: 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine (CAS 13960-34-4) is a chemical compound with molecular formula C21H12N6O6 and molecular weight 444.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-tris(4-nitrophenyl)-1,3,5-triazine
Also Known As: 2,4,6-tris(4-nitrophenyl)-1,3,5-triazine, tris(4-nitrophenyl)-1,3,5-triazine, J2.252.867J, RefChem:245923
| Molecular Formula | C21H12N6O6 |
|---|---|
| Molecular Weight | 444.08 g/mol |
| LogP | 4.5972 |
| Topological Polar Surface Area | 168.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.08182 |
| Heavy Atoms | 33 |
| Complexity | 1189.8519 |
Chemical Identifiers
| CAS Number | 13960-34-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC(=NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine (CAS 13960-34-4), with molecular formula C21H12N6O6 and molecular weight 444.08 g/mol. IUPAC: 2,4,6-tris(4-nitrophenyl)-1,3,5-triazine.
Chemical Property Profile of 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine
Property Insights of 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine
The XLogP value of 4.5972 indicates that 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 168.09 Ų indicates high polarity, suggesting 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine has 0 hydrogen bond donor(s) and 9 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 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine?
The CAS number of 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine is 13960-34-4.
What is the molecular formula of 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine?
The molecular formula of 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine is C21H12N6O6.
What is the molecular weight of 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine?
The molecular weight of 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine is 444.08 g/mol.
Where can I buy 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine?
You can request a quote for 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine 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-nitrophenyl)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Tris(4-nitrophenyl)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.