ZJ2NKN7S2F
TL;DR: ZJ2NKN7S2F (CAS 95008-84-7) is a chemical compound with molecular formula C16H14N2O16S4 and molecular weight 617.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dihydroxy-9,10-dioxo-4,8-bis(sulfomethylamino)anthracene-2,6-disulfonic acid
Also Known As: 9,10-Dihydro-1,5-dihydroxy-9,10-dioxo-4,8-bis((sulphomethyl)amino)anthracene-2,6-disulphonic acid, 9,10-Dihydro-1,5-dihydroxy-9,10-dioxo-4,8-bis((sulfomethyl)amino)anthracene-2,6-disulfonic acid, 1,5-DIHYDROXY-9,10-DIOXO-4,8-BIS[(SULFOMETHYL)AMINO]-9,10-DIHYDROANTHRACENE-2,6-DISULFONIC ACID, 1,5-dihydroxy-9,10-dioxo-4,8-bis(sulfomethylamino)anthracene-2,6-disulfonic acid, 9,10-dihydro-1,5-dihydroxy-9,10-dioxo-4,8-bis[ amino]anthracene-2,6-disulphonicacid
| Molecular Formula | C16H14N2O16S4 |
|---|---|
| Molecular Weight | 617.92 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 350.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 8 |
| Exact Mass | 617.9226 |
| Heavy Atoms | 38 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 95008-84-7 |
|---|---|
| SMILES | C1=C(C2=C(C(=C1S(=O)(=O)O)O)C(=O)C3=C(C2=O)C(=C(C=C3NCS(=O)(=O)O)S(=O)(=O)O)O)NCS(=O)(=O)O |
| InChIKey | OJLSSPVEXKDPHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ZJ2NKN7S2F (CAS 95008-84-7), with molecular formula C16H14N2O16S4 and molecular weight 617.92 g/mol. IUPAC: 1,5-dihydroxy-9,10-dioxo-4,8-bis(sulfomethylamino)anthracene-2,6-disulfonic acid.
Chemical Property Profile of ZJ2NKN7S2F
Property Insights of ZJ2NKN7S2F
The XLogP value of -1.3 indicates that ZJ2NKN7S2F is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 350.0 Ų indicates high polarity, suggesting ZJ2NKN7S2F may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ZJ2NKN7S2F has 8 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ZJ2NKN7S2F?
The CAS number of ZJ2NKN7S2F is 95008-84-7.
What is the molecular formula of ZJ2NKN7S2F?
The molecular formula of ZJ2NKN7S2F is C16H14N2O16S4.
What is the molecular weight of ZJ2NKN7S2F?
The molecular weight of ZJ2NKN7S2F is 617.92 g/mol.
Where can I buy ZJ2NKN7S2F?
You can request a quote for ZJ2NKN7S2F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZJ2NKN7S2F?
Yes, KEHONG BIO provides custom synthesis services for ZJ2NKN7S2F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.