9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-
TL;DR: 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- (CAS 14449-97-9) is a chemical compound with molecular formula C20H12N4O6 and molecular weight 404.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-(2,4-dinitroanilino)anthracene-9,10-dione
Also Known As: EINECS 238-429-2, 1-Amino-4-(2,4-dinitroanilino)anthraquinone, 1-amino-4-(2,4-dinitroanilino)anthracene-9,10-dione, 9,10-Anthracenedione, 1-amino-4-[(2,4-dinitrophenyl)amino]-, Anthraquinone, 1-amino-4-(2,4-dinitroanilino)-
| Molecular Formula | C20H12N4O6 |
|---|---|
| Molecular Weight | 404.08 g/mol |
| LogP | 3.6042 |
| Topological Polar Surface Area | 158.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.07568 |
| Heavy Atoms | 30 |
| Complexity | 1284.2834 |
Chemical Identifiers
| CAS Number | 14449-97-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])N |
Product Overview
9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- (CAS 14449-97-9), with molecular formula C20H12N4O6 and molecular weight 404.08 g/mol. IUPAC: 1-amino-4-(2,4-dinitroanilino)anthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-
Property Insights of 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-
The XLogP value of 3.6042 indicates that 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 158.47 Ų indicates high polarity, suggesting 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- has 2 hydrogen bond donor(s) and 8 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-amino-4-((2,4-dinitrophenyl)amino)-?
The CAS number of 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- is 14449-97-9.
What is the molecular formula of 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-?
The molecular formula of 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- is C20H12N4O6.
What is the molecular weight of 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-?
The molecular weight of 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- is 404.08 g/mol.
Where can I buy 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-?
You can request a quote for 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- 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-amino-4-((2,4-dinitrophenyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.