Tribenzyl isocyanurate
TL;DR: Tribenzyl isocyanurate (CAS 606-03-1) is a chemical compound with molecular formula C24H21N3O3 and molecular weight 399.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tribenzyl-1,3,5-triazinane-2,4,6-trione
Also Known As: TRIBENZYL ISOCYANURATE, Benzyl isocyanurate, 1,3,5-tribenzyl-1,3,5-triazinane-2,4,6-trione, 1,3,5-TRIBENZYL ISOCYANURATE, 1,3,5-Tribenzyl-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C24H21N3O3 |
|---|---|
| Molecular Weight | 399.16 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.1583 |
| Heavy Atoms | 30 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 606-03-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)N(C(=O)N(C2=O)CC3=CC=CC=C3)CC4=CC=CC=C4 |
| InChIKey | PIBKGXNSYQOGKL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tribenzyl isocyanurate (CAS 606-03-1), with molecular formula C24H21N3O3 and molecular weight 399.16 g/mol. IUPAC: 1,3,5-tribenzyl-1,3,5-triazinane-2,4,6-trione.
Chemical Property Profile of Tribenzyl isocyanurate
Property Insights of Tribenzyl isocyanurate
The XLogP value of 3.9 indicates that Tribenzyl isocyanurate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Tribenzyl isocyanurate. Following Lipinski's Rule of Five, Tribenzyl isocyanurate 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 Tribenzyl isocyanurate?
The CAS number of Tribenzyl isocyanurate is 606-03-1.
What is the molecular formula of Tribenzyl isocyanurate?
The molecular formula of Tribenzyl isocyanurate is C24H21N3O3.
What is the molecular weight of Tribenzyl isocyanurate?
The molecular weight of Tribenzyl isocyanurate is 399.16 g/mol.
Where can I buy Tribenzyl isocyanurate?
You can request a quote for Tribenzyl isocyanurate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tribenzyl isocyanurate?
Yes, KEHONG BIO provides custom synthesis services for Tribenzyl isocyanurate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.