2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester
TL;DR: 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester (CAS 14130-41-7) is a chemical compound with molecular formula C20H14N2O5S and molecular weight 394.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 1,4-diamino-9,10-dioxoanthracene-2-sulfonate
Also Known As: Phenyl 1,4-diaminoanthraquinone-2-sulfonate, 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester, phenyl 1,4-diamino-9,10-dioxoanthracene-2-sulfonate, Phenyl 1,4-diamino-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate, phenyl 1,4-diamino-9,10-dioxo-anthracene-2-sulfonate
| Molecular Formula | C20H14N2O5S |
|---|---|
| Molecular Weight | 394.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.06235 |
| Heavy Atoms | 28 |
| Complexity | 727.0 |
Chemical Identifiers
| CAS Number | 14130-41-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)OS(=O)(=O)C2=C(C3=C(C(=C2)N)C(=O)C4=CC=CC=C4C3=O)N |
| InChIKey | DQTIHYAULLHSID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester (CAS 14130-41-7), with molecular formula C20H14N2O5S and molecular weight 394.06 g/mol. IUPAC: phenyl 1,4-diamino-9,10-dioxoanthracene-2-sulfonate.
Chemical Property Profile of 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester
Property Insights of 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester
The XLogP value of 3.7 indicates that 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester. Following Lipinski's Rule of Five, 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester has 2 hydrogen bond donor(s) and 7 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, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester?
The CAS number of 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester is 14130-41-7.
What is the molecular formula of 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester?
The molecular formula of 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester is C20H14N2O5S.
What is the molecular weight of 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester?
The molecular weight of 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester is 394.06 g/mol.
Where can I buy 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester?
You can request a quote for 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester 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, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Anthracenesulfonic acid, 1,4-diamino-9,10-dihydro-9,10-dioxo-, phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.