3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid
TL;DR: 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid (CAS 487018-56-4) is a chemical compound with molecular formula C19H15N3O7 and molecular weight 397.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-(3-carboxyphenoxy)-6-ethoxy-1,3,5-triazin-2-yl]oxy]benzoic acid
Also Known As: 3,3'-((6-ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid, 3,3'-[(6-ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy)]dibenzoic acid, 3-[[4-(3-carboxyphenoxy)-6-ethoxy-1,3,5-triazin-2-yl]oxy]benzoic acid
| Molecular Formula | C19H15N3O7 |
|---|---|
| Molecular Weight | 397.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.091 |
| Heavy Atoms | 29 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 487018-56-4 |
|---|---|
| SMILES | CCOC1=NC(=NC(=N1)OC2=CC=CC(=C2)C(=O)O)OC3=CC=CC(=C3)C(=O)O |
| InChIKey | HMAVMGYVGLNEKY-UHFFFAOYSA-N |
Product Overview
3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid (CAS 487018-56-4), with molecular formula C19H15N3O7 and molecular weight 397.09 g/mol. IUPAC: 3-[[4-(3-carboxyphenoxy)-6-ethoxy-1,3,5-triazin-2-yl]oxy]benzoic acid.
Chemical Property Profile of 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid
Property Insights of 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid
The XLogP value of 3.4 indicates that 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid has 2 hydrogen bond donor(s) and 10 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 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid?
The CAS number of 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid is 487018-56-4.
What is the molecular formula of 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid?
The molecular formula of 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid is C19H15N3O7.
What is the molecular weight of 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid?
The molecular weight of 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid is 397.09 g/mol.
Where can I buy 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid?
You can request a quote for 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-((6-Ethoxy-1,3,5-triazine-2,4-diyl)bis(oxy))dibenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.