2-Methyl-7-toluidinoquinacridone-6-carboxylic acid
TL;DR: 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid (CAS 101904-52-3) is a chemical compound with molecular formula C22H18N2O3 and molecular weight 358.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-2-(4-methylanilino)-9-oxo-10H-acridine-3-carboxylic acid
Also Known As: 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid, 3-Acridinecarboxylic acid, 9,10-dihydro-7-methyl-2-((4-methylphenyl)amino)-9-oxo-, 7-methyl-2-(4-methylanilino)-9-oxo-10H-acridine-3-carboxylic acid, 9,10-Dihydro-7-methyl-2-((4-methylphenyl)amino)-9-oxo-3-acridinecarboxylic acid, TMAS; 3-Acridinecarboxylic acid, 9,10-dihydro-7-methyl-2-[(4-methylphenyl)amino]-9-oxo
| Molecular Formula | C22H18N2O3 |
|---|---|
| Molecular Weight | 358.13 g/mol |
| LogP | 4.73994 |
| Topological Polar Surface Area | 82.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.13174 |
| Heavy Atoms | 27 |
| Complexity | 1254.7695 |
Chemical Identifiers
| CAS Number | 101904-52-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=C(C=C3C(=C2)C(=O)C4=C(N3)C=CC(=C4)C)C(=O)O |
Product Overview
2-Methyl-7-toluidinoquinacridone-6-carboxylic acid (CAS 101904-52-3), with molecular formula C22H18N2O3 and molecular weight 358.13 g/mol. IUPAC: 7-methyl-2-(4-methylanilino)-9-oxo-10H-acridine-3-carboxylic acid.
Chemical Property Profile of 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid
Property Insights of 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid
The XLogP value of 4.73994 indicates that 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid. Following Lipinski's Rule of Five, 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid has 3 hydrogen bond donor(s) and 3 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-Methyl-7-toluidinoquinacridone-6-carboxylic acid?
The CAS number of 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid is 101904-52-3.
What is the molecular formula of 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid?
The molecular formula of 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid is C22H18N2O3.
What is the molecular weight of 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid?
The molecular weight of 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid is 358.13 g/mol.
Where can I buy 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid?
You can request a quote for 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-7-toluidinoquinacridone-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.