2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-
TL;DR: 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- (CAS 77847-19-9) is a chemical compound with molecular formula C21H18N2O8S2 and molecular weight 490.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8aR,10aR)-1-amino-4-(4-methyl-3-sulfoanilino)-9,10-dioxo-8a,10a-dihydroanthracene-2-sulfonic acid
Also Known As: 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-, (8aR,10aR)-1-amino-4-(4-methyl-3-sulfoanilino)-9,10-dioxo-8a,10a-dihydroanthracene-2-sulfonic acid
| Molecular Formula | C21H18N2O8S2 |
|---|---|
| Molecular Weight | 490.05 g/mol |
| LogP | 2.55162 |
| Topological Polar Surface Area | 180.93 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 490.05045 |
| Heavy Atoms | 33 |
| Complexity | 1505.1447 |
Chemical Identifiers
| CAS Number | 77847-19-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=CC(=C(C3=C2C(=O)[C@@H]4C=CC=C[C@H]4C3=O)N)S(=O)(=O)O)S(=O)(=O)O |
Product Overview
2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- (CAS 77847-19-9), with molecular formula C21H18N2O8S2 and molecular weight 490.05 g/mol. IUPAC: (8aR,10aR)-1-amino-4-(4-methyl-3-sulfoanilino)-9,10-dioxo-8a,10a-dihydroanthracene-2-sulfonic acid.
Chemical Property Profile of 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-
Property Insights of 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-
The XLogP value of 2.55162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-. The TPSA of 180.93 Ų indicates high polarity, suggesting 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- 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 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-?
The CAS number of 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- is 77847-19-9.
What is the molecular formula of 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-?
The molecular formula of 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- is C21H18N2O8S2.
What is the molecular weight of 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-?
The molecular weight of 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- is 490.05 g/mol.
Where can I buy 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-?
You can request a quote for 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo-?
Yes, KEHONG BIO provides custom synthesis services for 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-methyl-3-sulfophenyl)amino)-9,10-dioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.