2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate
TL;DR: 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate (CAS 898-22-6) is a chemical compound with molecular formula C12H15N3O6 and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triethyl 1,3,5-triazine-2,4,6-tricarboxylate
Also Known As: Triethyl 1,3,5-triazine-2,4,6-tricarboxylate, 2,4,6-triethyl 1,3,5-triazine-2,4,6-tricarboxylate, 2,4,6-Triethoxycarbonyl-s-triazine, 2,4,6-Triethoxycarbonyl-1,3,5-triazine, TRIETHYL135-TRIAZINE-246-TRICARBOX&
| Molecular Formula | C12H15N3O6 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 297.0961 |
| Heavy Atoms | 21 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 898-22-6 |
|---|---|
| SMILES | CCOC(=O)C1=NC(=NC(=N1)C(=O)OCC)C(=O)OCC |
| InChIKey | LKNPNZKIOSOWES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate (CAS 898-22-6), with molecular formula C12H15N3O6 and molecular weight 297.10 g/mol. IUPAC: triethyl 1,3,5-triazine-2,4,6-tricarboxylate.
Chemical Property Profile of 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate
Property Insights of 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate. Following Lipinski's Rule of Five, 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate 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-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate?
The CAS number of 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate is 898-22-6.
What is the molecular formula of 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate?
The molecular formula of 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate is C12H15N3O6.
What is the molecular weight of 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate?
The molecular weight of 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate is 297.10 g/mol.
Where can I buy 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate?
You can request a quote for 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate 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-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Triethyl 1,3,5-triazine-2,4,6-tricarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.