9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-
TL;DR: 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- (CAS 3753-50-2) is a chemical compound with molecular formula C22H16N2O6 and molecular weight 404.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)phenyl] acetate
Also Known As: 1,5-Diamino-4,8-dihydroxy-3-(4-(acetyloxy)phenyl)-9,10-anthracenedione, 9,10-Anthracenedione, 2-[4-(acetyloxy)phenyl]-4,8-diamino-1,5-dihydroxy-, [4-(4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)phenyl] acetate, 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-, p-((4,8-Diamino-1,5-dihydroxy-9,10-dioxo-9,10-dihydro-2-anthryl)oxy)phenyl acetate
| Molecular Formula | C22H16N2O6 |
|---|---|
| Molecular Weight | 404.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.10083 |
| Heavy Atoms | 30 |
| Complexity | 706.0 |
Chemical Identifiers
| CAS Number | 3753-50-2 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N |
| InChIKey | ODMIJAPLDKMEPD-UHFFFAOYSA-N |
Product Overview
9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- (CAS 3753-50-2), with molecular formula C22H16N2O6 and molecular weight 404.10 g/mol. IUPAC: [4-(4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)phenyl] acetate.
Chemical Property Profile of 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-
Property Insights of 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-
The XLogP value of 3.3 indicates that 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- has 4 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, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-?
The CAS number of 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- is 3753-50-2.
What is the molecular formula of 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-?
The molecular formula of 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- is C22H16N2O6.
What is the molecular weight of 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-?
The molecular weight of 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- is 404.10 g/mol.
Where can I buy 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-?
You can request a quote for 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- 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, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 2-(4-(acetyloxy)phenyl)-4,8-diamino-1,5-dihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.