Triphenodioxazine-1,8-dicarboxylic acid
TL;DR: Triphenodioxazine-1,8-dicarboxylic acid (CAS 136497-59-1) is a chemical compound with molecular formula C20H10N2O6 and molecular weight 374.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,4]benzoxazino[3,2-i]phenoxazine-1,8-dicarboxylic acid
Also Known As: TPODC, Triphenodioxazine-1,8-dicarboxylic acid, 1,8-Triphenodioxazinedicarboxylic acid, 1,8-Triphenodioxazinedicarboxylicacid, [1,4]benzoxazino[3,2-i]phenoxazine-1,8-dicarboxylic acid
| Molecular Formula | C20H10N2O6 |
|---|---|
| Molecular Weight | 374.05 g/mol |
| LogP | 3.197 |
| Topological Polar Surface Area | 117.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.0539 |
| Heavy Atoms | 28 |
| Complexity | 1226.003 |
Chemical Identifiers
| CAS Number | 136497-59-1 |
|---|---|
| SMILES | C1=CC(=C2C(=C1)OC3=CC4=NC5=C(C=CC=C5OC4=CC3=N2)C(=O)O)C(=O)O |
Product Overview
Triphenodioxazine-1,8-dicarboxylic acid (CAS 136497-59-1), with molecular formula C20H10N2O6 and molecular weight 374.05 g/mol. IUPAC: [1,4]benzoxazino[3,2-i]phenoxazine-1,8-dicarboxylic acid.
Chemical Property Profile of Triphenodioxazine-1,8-dicarboxylic acid
Property Insights of Triphenodioxazine-1,8-dicarboxylic acid
The XLogP value of 3.197 indicates that Triphenodioxazine-1,8-dicarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Triphenodioxazine-1,8-dicarboxylic acid. Following Lipinski's Rule of Five, Triphenodioxazine-1,8-dicarboxylic acid has 2 hydrogen bond donor(s) and 6 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 Triphenodioxazine-1,8-dicarboxylic acid?
The CAS number of Triphenodioxazine-1,8-dicarboxylic acid is 136497-59-1.
What is the molecular formula of Triphenodioxazine-1,8-dicarboxylic acid?
The molecular formula of Triphenodioxazine-1,8-dicarboxylic acid is C20H10N2O6.
What is the molecular weight of Triphenodioxazine-1,8-dicarboxylic acid?
The molecular weight of Triphenodioxazine-1,8-dicarboxylic acid is 374.05 g/mol.
Where can I buy Triphenodioxazine-1,8-dicarboxylic acid?
You can request a quote for Triphenodioxazine-1,8-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triphenodioxazine-1,8-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Triphenodioxazine-1,8-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.