4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate
TL;DR: 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate (CAS 862806-40-4) is a chemical compound with molecular formula C22H17NO6S and molecular weight 423.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetamidophenyl) 9,10-dioxo-8a,10a-dihydroanthracene-1-sulfonate
Also Known As: 4-acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate, F0433-0586, (4-acetamidophenyl) 9,10-dioxo-8a,10a-dihydroanthracene-1-sulfonate, N-[4-[(9,10-dioxo-8a,10a-dihydroanthracen-1-yl)sulfonyloxy]phenyl]acetamide, (p-acetylaminophenoxy)-9,10-dioxo-8a,9,10,10a-tetrahydro-1-anthryl(oxo)-lambda-sulfaniumolate
| Molecular Formula | C22H17NO6S |
|---|---|
| Molecular Weight | 423.08 g/mol |
| LogP | 3.1501 |
| Topological Polar Surface Area | 106.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.07767 |
| Heavy Atoms | 30 |
| Complexity | 1224.7742 |
Chemical Identifiers
| CAS Number | 862806-40-4 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C(=O)C4C=CC=CC4C3=O |
Product Overview
4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate (CAS 862806-40-4), with molecular formula C22H17NO6S and molecular weight 423.08 g/mol. IUPAC: (4-acetamidophenyl) 9,10-dioxo-8a,10a-dihydroanthracene-1-sulfonate.
Chemical Property Profile of 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate
Property Insights of 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate
The XLogP value of 3.1501 indicates that 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate. Following Lipinski's Rule of Five, 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate has 1 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-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate?
The CAS number of 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate is 862806-40-4.
What is the molecular formula of 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate?
The molecular formula of 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate is C22H17NO6S.
What is the molecular weight of 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate?
The molecular weight of 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate is 423.08 g/mol.
Where can I buy 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate?
You can request a quote for 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetamidophenyl 9,10-dioxo-8a,9,10,10a-tetrahydroanthracene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.