Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate
TL;DR: Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate (CAS 1323-87-1) is a chemical compound with molecular formula C14H8Cl2N2O5S and molecular weight 385.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,8-diamino-6,7-dichloro-9,10-dioxoanthracene-1-sulfonic acid
Also Known As: 5,8-diamino-6,7-dichloro-9,10-dioxoanthracene-1-sulfonic acid, Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate, 5,8-diamino-6,7-dichloro-9,10-dioxo-anthracene-1-sulfonic Acid, 5,8-Diamino-6,7-dichloro-9,10-dioxo-9,10-dihydro-1-anthracenesulfonic acid, 5,8-diamino-6,7-dichloro-9,10-dioxo-9,10-dihydroanthracene-1-sulfonic acid
| Molecular Formula | C14H8Cl2N2O5S |
|---|---|
| Molecular Weight | 385.95 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 385.9531 |
| Heavy Atoms | 24 |
| Complexity | 667.0 |
Chemical Identifiers
| CAS Number | 1323-87-1 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)C3=C(C2=O)C(=C(C(=C3N)Cl)Cl)N |
| InChIKey | WVWSLCJRULYUMP-UHFFFAOYSA-N |
Product Overview
Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate (CAS 1323-87-1), with molecular formula C14H8Cl2N2O5S and molecular weight 385.95 g/mol. IUPAC: 5,8-diamino-6,7-dichloro-9,10-dioxoanthracene-1-sulfonic acid.
Chemical Property Profile of Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate
Property Insights of Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate. The TPSA of 149.0 Ų indicates high polarity, suggesting Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate has 3 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 Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate?
The CAS number of Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate is 1323-87-1.
What is the molecular formula of Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate?
The molecular formula of Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate is C14H8Cl2N2O5S.
What is the molecular weight of Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate?
The molecular weight of Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate is 385.95 g/mol.
Where can I buy Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate?
You can request a quote for Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate?
Yes, KEHONG BIO provides custom synthesis services for Sodium 5,8-diamino-6,7-dichloro-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.