TL;DR: RefChem:465283 (CAS 32866-11-8) is a chemical compound with molecular formula C20H13N3Na2O8S2 and molecular weight 532.99396 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;1-amino-4-(4-amino-3-sulfonatoanilino)-9,10-dioxoanthracene-2-sulfonate
Also Known As: 2-(hydroxymethyl)-6-methyl-4-methylsulfanylphenol, 2-Anthraquinonesulfonic acid, 1-amino-4-((4-amino-3-sulfophenyl)amino)-, sodium salt, 1-Amino-4-(4-amino-3-sulphoanilino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonic acid, sodium salt, 2-Anthracenesulfonic acid, 1-amino-4-((4-amino-3-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-, sodium salt (1:?), disodium 1-amino-4-[(4-amino-3-sulfonatophenyl)amino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H13N3Na2O8S2 |
| Molecular Weight | 532.99396 g/mol |
| XLogP | -4.81 |
| Topological Polar Surface Area (TPSA) | 229.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 532.99396 Da |
| Heavy Atoms | 35 |
| Complexity | 979.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+] |
| InChIKey | GUCIZQSDEMEOAP-UHFFFAOYSA-L |
The XLogP value of -4.81 indicates that RefChem:465283 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 229.0 Ų indicates high polarity, suggesting RefChem:465283 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:465283 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:465283 is 32866-11-8.
The molecular formula of RefChem:465283 is C20H13N3Na2O8S2.
The molecular weight of RefChem:465283 is 532.99396 g/mol.
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