9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-
TL;DR: 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- (CAS 61604-82-8) is a chemical compound with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-diamino-4,5-dimethoxyanthracene-9,10-dione
Also Known As: 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-, 1,8-Diamino-4,5-dimethoxy-9,10-anthracenedione, 1,8-diamino-4,5-dimethoxyanthracene-9,10-dione
| Molecular Formula | C16H14N2O4 |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.09537 |
| Heavy Atoms | 22 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 61604-82-8 |
|---|---|
| SMILES | COC1=C2C(=C(C=C1)N)C(=O)C3=C(C=CC(=C3C2=O)OC)N |
| InChIKey | FKOHDHUCSAALQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- (CAS 61604-82-8), with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol. IUPAC: 1,8-diamino-4,5-dimethoxyanthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-
Property Insights of 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- has 2 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 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-?
The CAS number of 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- is 61604-82-8.
What is the molecular formula of 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-?
The molecular formula of 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- is C16H14N2O4.
What is the molecular weight of 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-?
The molecular weight of 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- is 298.10 g/mol.
Where can I buy 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-?
You can request a quote for 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1,8-diamino-4,5-dimethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.