![4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid structure](/static/products/6575/65758-35-2.webp)
4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid
TL;DR: 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid (CAS 65758-35-2) is a chemical compound with molecular formula C14H12O6S and molecular weight 308.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)sulfanylbutanoic acid
Also Known As: 4-[(5,8-dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid, 4-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)sulfanylbutanoic acid, 4-[(1,4-Dihydro-5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)thio]butanoic acid, 4-[(5,8-Dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)sulfanyl]butanoic acid, Butanoic acid, 4-[(1,4-dihydro-5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)thio]-
| Molecular Formula | C14H12O6S |
|---|---|
| Molecular Weight | 308.04 g/mol |
| LogP | 1.9587 |
| Topological Polar Surface Area | 111.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.03546 |
| Heavy Atoms | 21 |
| Complexity | 661.6732 |
Chemical Identifiers
| CAS Number | 65758-35-2 |
|---|---|
| SMILES | C1=CC(=C2C(=C1O)C(=O)C=C(C2=O)SCCCC(=O)O)O |
Product Overview
4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid (CAS 65758-35-2), with molecular formula C14H12O6S and molecular weight 308.04 g/mol. IUPAC: 4-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)sulfanylbutanoic acid.
Chemical Property Profile of 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid
Property Insights of 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid
The XLogP value of 1.9587 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid. The TPSA of 111.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid. Following Lipinski's Rule of Five, 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid has 3 hydrogen bond donor(s) and 6 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-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid?
The CAS number of 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid is 65758-35-2.
What is the molecular formula of 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid?
The molecular formula of 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid is C14H12O6S.
What is the molecular weight of 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid?
The molecular weight of 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid is 308.04 g/mol.
Where can I buy 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid?
You can request a quote for 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(5,8-Dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.