1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone
TL;DR: 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone (CAS 6313-46-8) is a chemical compound with molecular formula C14H9NO3S and molecular weight 271.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-hydroxy-2-sulfanylanthracene-9,10-dione
Also Known As: 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone, 9, 1-amino-4-hydroxy-2-mercapto-, 1-amino-4-hydroxy-2-sulfanylanthracene-9,10-dione, 9,10-Anthracenedione, 1-amino-4-hydroxy-2-mercapto-, 1-amino-2-mercapto-4-hydroxyanthraquinone
| Molecular Formula | C14H9NO3S |
|---|---|
| Molecular Weight | 271.03 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 271.0303 |
| Heavy Atoms | 19 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 6313-46-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)S)N |
| InChIKey | FRYOPPDGWFBTKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone (CAS 6313-46-8), with molecular formula C14H9NO3S and molecular weight 271.03 g/mol. IUPAC: 1-amino-4-hydroxy-2-sulfanylanthracene-9,10-dione.
Chemical Property Profile of 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone
Property Insights of 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone
The XLogP value of 3.1 indicates that 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone. Following Lipinski's Rule of Five, 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone has 3 hydrogen bond donor(s) and 5 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 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone?
The CAS number of 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone is 6313-46-8.
What is the molecular formula of 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone?
The molecular formula of 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone is C14H9NO3S.
What is the molecular weight of 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone?
The molecular weight of 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone is 271.03 g/mol.
Where can I buy 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone?
You can request a quote for 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Amino-4-hydroxy-2-mercaptoanthra-9,10-quinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.