3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid
TL;DR: 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid (CAS 461029-53-8) is a chemical compound with molecular formula C19H15NO6 and molecular weight 353.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]benzoic acid
Also Known As: CBKinase1_009723, CBKinase1_022123, AB01293586-01, 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid, 3-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]benzoic Acid
| Molecular Formula | C19H15NO6 |
|---|---|
| Molecular Weight | 353.09 g/mol |
| LogP | 2.81712 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.08994 |
| Heavy Atoms | 26 |
| Complexity | 1053.3239 |
Chemical Identifiers
| CAS Number | 461029-53-8 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3=CC=CC(=C3)C(=O)O |
Product Overview
3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid (CAS 461029-53-8), with molecular formula C19H15NO6 and molecular weight 353.09 g/mol. IUPAC: 3-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]benzoic acid.
Chemical Property Profile of 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid
Property Insights of 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid
The XLogP value of 2.81712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid. Following Lipinski's Rule of Five, 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid has 2 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 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid?
The CAS number of 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid is 461029-53-8.
What is the molecular formula of 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid?
The molecular formula of 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid is C19H15NO6.
What is the molecular weight of 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid?
The molecular weight of 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid is 353.09 g/mol.
Where can I buy 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid?
You can request a quote for 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.