Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate
TL;DR: Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate (CAS 29366-67-4) is a chemical compound with molecular formula C18H15N3O2 and molecular weight 305.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate
Also Known As: Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate, s-Triazine-2-carboxylic acid, 4,6-diphenyl-, ethyl ester, Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate #, 4,6-Diphenyl-1,3,5-triazine-2-carboxylic acid ethyl ester, RefChem:343612
| Molecular Formula | C18H15N3O2 |
|---|---|
| Molecular Weight | 305.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.11642 |
| Heavy Atoms | 23 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 29366-67-4 |
|---|---|
| SMILES | CCOC(=O)C1=NC(=NC(=N1)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | YVGWVLZLUIAWNL-UHFFFAOYSA-N |
Product Overview
Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate (CAS 29366-67-4), with molecular formula C18H15N3O2 and molecular weight 305.12 g/mol. IUPAC: ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate.
Chemical Property Profile of Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate
Property Insights of Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate
The XLogP value of 3.8 indicates that Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate has 0 hydrogen bond donor(s) and 5 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 Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate?
The CAS number of Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate is 29366-67-4.
What is the molecular formula of Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate?
The molecular formula of Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate is C18H15N3O2.
What is the molecular weight of Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate?
The molecular weight of Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate is 305.12 g/mol.
Where can I buy Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate?
You can request a quote for Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4,6-diphenyl-1,3,5-triazine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.