3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid
TL;DR: 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid (CAS 1023870-85-0) is a chemical compound with molecular formula C24H19NO5 and molecular weight 401.1263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[2-(3,4-dimethoxyphenyl)-3-oxoinden-1-yl]amino]benzoic acid
Also Known As: 3-((2-(3,4-DIMETHOXYPHENYL)-1-OXOINDEN-3-YL)AMINO)BENZOIC ACID, 3-[[2-(3,4-dimethoxyphenyl)-3-oxoinden-1-yl]amino]benzoic acid, 3-[[2-(3,4-dimethoxyphenyl)-3-oxo-inden-1-yl]amino]benzoic Acid, 3-{[2-(3,4-dimethoxyphenyl)-1-oxo-1H-inden-3-yl]amino}benzoic acid
Technical Specifications
| Molecular Formula | C24H19NO5 |
| Molecular Weight | 401.1263 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.1263 Da |
| Heavy Atoms | 30 |
| Complexity | 689.0 |
| SMILES | COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O)OC |
| InChIKey | ZHDZBDGPXJHQAY-UHFFFAOYSA-N |
Chemical Property Profile of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid
Property Insights of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid
The XLogP value of 4.3 indicates that 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid. Following Lipinski's Rule of Five, 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic 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
What is the CAS number of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid?
The CAS number of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid is 1023870-85-0.
What is the molecular formula of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid?
The molecular formula of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid is C24H19NO5.
What is the molecular weight of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid?
The molecular weight of 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid is 401.1263 g/mol.
Where can I buy 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid?
You can request a quote for 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 3-((2-(3,4-Dimethoxyphenyl)-1-oxoinden-3-YL)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.