![4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid structure](/static/products/3515/351516-91-1.webp)
4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid
TL;DR: 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid (CAS 351516-91-1) is a chemical compound with molecular formula C18H11NO5 and molecular weight 321.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(9,10-dioxoanthracen-2-yl)amino]-4-oxobut-2-enoic acid
Also Known As: 4-[(9,10-dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid, 4-[(9,10-dioxoanthracen-2-yl)amino]-4-oxobut-2-enoic acid, (2E)-3-[(9,10-DIOXOANTHRACEN-2-YL)CARBAMOYL]PROP-2-ENOIC ACID, (E)-4-((9,10-dioxo-9,10-dihydroanthracen-2-yl)amino)-4-oxobut-2-enoic acid
| Molecular Formula | C18H11NO5 |
|---|---|
| Molecular Weight | 321.06 g/mol |
| LogP | 2.0413 |
| Topological Polar Surface Area | 100.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.06372 |
| Heavy Atoms | 24 |
| Complexity | 926.7564 |
Chemical Identifiers
| CAS Number | 351516-91-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=O)C=CC(=O)O |
Product Overview
4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid (CAS 351516-91-1), with molecular formula C18H11NO5 and molecular weight 321.06 g/mol. IUPAC: 4-[(9,10-dioxoanthracen-2-yl)amino]-4-oxobut-2-enoic acid.
Chemical Property Profile of 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid
Property Insights of 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid
The XLogP value of 2.0413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid. The TPSA of 100.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid. Following Lipinski's Rule of Five, 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic 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-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid?
The CAS number of 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid is 351516-91-1.
What is the molecular formula of 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid?
The molecular formula of 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid is C18H11NO5.
What is the molecular weight of 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid?
The molecular weight of 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid is 321.06 g/mol.
Where can I buy 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid?
You can request a quote for 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic 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-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(9,10-Dioxo-2-anthryl)amino]-4-oxo-but-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.