![4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid structure](/static/products/1652/16522-97-7.webp)
4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid
TL;DR: 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid (CAS 16522-97-7) is a chemical compound with molecular formula C18H13NO5 and molecular weight 323.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(9,10-dioxoanthracen-1-yl)amino]-4-oxobutanoic acid
Also Known As: 3-[(9,10-dioxoanthracen-1-yl)carbamoyl]propanoic Acid, 3-[N-(9,10-dioxoanthryl)carbamoyl]propanoic acid, 4-[(9,10-dioxoanthracen-1-yl)amino]-4-oxobutanoic acid, 4-[(9,10-dioxo-1-anthryl)amino]-4-oxo-butanoic acid, 4-[(9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]-4-oxobutanoic acid
| Molecular Formula | C18H13NO5 |
|---|---|
| Molecular Weight | 323.08 g/mol |
| LogP | 2.2653 |
| Topological Polar Surface Area | 100.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.07938 |
| Heavy Atoms | 24 |
| Complexity | 884.7279 |
Chemical Identifiers
| CAS Number | 16522-97-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)CCC(=O)O |
Product Overview
4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid (CAS 16522-97-7), with molecular formula C18H13NO5 and molecular weight 323.08 g/mol. IUPAC: 4-[(9,10-dioxoanthracen-1-yl)amino]-4-oxobutanoic acid.
Chemical Property Profile of 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid
Property Insights of 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid
The XLogP value of 2.2653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid. The TPSA of 100.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid has 2 hydrogen bond donor(s) and 4 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 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid?
The CAS number of 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid is 16522-97-7.
What is the molecular formula of 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid?
The molecular formula of 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid is C18H13NO5.
What is the molecular weight of 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid?
The molecular weight of 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid is 323.08 g/mol.
Where can I buy 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid?
You can request a quote for 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(9,10-Dioxoanthracen-1-yl)amino]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.