![2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid structure](/static/products/2756/27563-39-9.webp)
2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid
TL;DR: 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid (CAS 27563-39-9) is a chemical compound with molecular formula C13H10ClNO4 and molecular weight 279.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]propanoic acid
Also Known As: 2-[(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid, 2-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]propanoic acid, F1268-0008, 2-((3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino)propanoic acid, N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)alanine
| Molecular Formula | C13H10ClNO4 |
|---|---|
| Molecular Weight | 279.03 g/mol |
| LogP | 1.5787 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.02985 |
| Heavy Atoms | 19 |
| Complexity | 620.82416 |
Chemical Identifiers
| CAS Number | 27563-39-9 |
|---|---|
| SMILES | CC(C(=O)O)NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl |
Product Overview
2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid (CAS 27563-39-9), with molecular formula C13H10ClNO4 and molecular weight 279.03 g/mol. IUPAC: 2-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]propanoic acid.
Chemical Property Profile of 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid
Property Insights of 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid
The XLogP value of 1.5787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid. Following Lipinski's Rule of Five, 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic 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 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid?
The CAS number of 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid is 27563-39-9.
What is the molecular formula of 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid?
The molecular formula of 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid is C13H10ClNO4.
What is the molecular weight of 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid?
The molecular weight of 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid is 279.03 g/mol.
Where can I buy 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid?
You can request a quote for 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.