1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione
TL;DR: 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione (CAS 98329-02-3) is a chemical compound with molecular formula C21H9Cl6N3O3 and molecular weight 560.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione
Also Known As: 1,3,5-tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione, BAS 00526923, NCI60_022134, J1.686.284C, 1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-tris(3,4-dichlorophenyl)-
| Molecular Formula | C21H9Cl6N3O3 |
|---|---|
| Molecular Weight | 560.88 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 560.8775 |
| Heavy Atoms | 33 |
| Complexity | 666.0 |
Chemical Identifiers
| CAS Number | 98329-02-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1N2C(=O)N(C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)Cl)Cl)Cl)Cl |
| InChIKey | FXOQGHKORJYZFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione (CAS 98329-02-3), with molecular formula C21H9Cl6N3O3 and molecular weight 560.88 g/mol. IUPAC: 1,3,5-tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione.
Chemical Property Profile of 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione
Property Insights of 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione
The XLogP value of 7.8 indicates that 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione 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 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione 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 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione?
The CAS number of 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione is 98329-02-3.
What is the molecular formula of 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione?
The molecular formula of 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione is C21H9Cl6N3O3.
What is the molecular weight of 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione?
The molecular weight of 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione is 560.88 g/mol.
Where can I buy 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione?
You can request a quote for 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tris(3,4-dichlorophenyl)-1,3,5-triazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.