![9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- structure](/static/products/4104/4104-49-8.webp)
9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-
TL;DR: 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- (CAS 4104-49-8) is a chemical compound with molecular formula C27H18N2O6 and molecular weight 466.12 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] benzoate
Also Known As: 1,5-Diamino-3-(4-(benzoyloxy)phenyl)-4,8-dihydroxy-9,10-anthracenedione, 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-, 9,10-Anthracenedione, 4,8-diamino-2-(4-(benzoyloxy)phenyl)-1,5-dihydroxy-, p-[4,8-diamino-1,5-dihydroxy-9,10-dihydro-9,10-dioxo-2-anthryl]phenyl benzoate, [4-(4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)phenyl] benzoate
| Molecular Formula | C27H18N2O6 |
|---|---|
| Molecular Weight | 466.12 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.1165 |
| Heavy Atoms | 35 |
| Complexity | 820.0 |
Chemical Identifiers
| CAS Number | 4104-49-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C4C(=C3O)C(=O)C5=C(C=CC(=C5C4=O)O)N)N |
| InChIKey | UTKGUAAJNFVYMR-UHFFFAOYSA-N |
Product Overview
9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- (CAS 4104-49-8), with molecular formula C27H18N2O6 and molecular weight 466.12 g/mol. IUPAC: [4-(4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)phenyl] benzoate.
Chemical Property Profile of 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-
Property Insights of 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-
The XLogP value of 4.9 indicates that 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-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, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-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, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-?
The CAS number of 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- is 4104-49-8.
What is the molecular formula of 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-?
The molecular formula of 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- is C27H18N2O6.
What is the molecular weight of 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-?
The molecular weight of 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- is 466.12 g/mol.
Where can I buy 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-?
You can request a quote for 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-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, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 4,8-diamino-2-[4-(benzoyloxy)phenyl]-1,5-dihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.