RefChem:563895
TL;DR: RefChem:563895 (CAS 70900-27-5) is a chemical compound with molecular formula C34H32N2Na2O8S2 and molecular weight 706.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;1,4-bis[4-(benzenesulfonyloxy)butan-2-ylimino]anthracene-9,10-diolate
Also Known As: Benzenesulfonic acid, ((9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(imino(3-methyl-3,1-propanediyl)))bis-, disodium salt, (9,10-Dihydro-9,10-dioxo-1,4-anthracenediyl)bis(imino(3-methyl-3,1-propanediyl))bis(benzenesulfonic acid), disodium salt, Benzenesulfonic acid, ((9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis(imino(3-methyl-3,1-propanediyl)))bis-, sodium salt (1:2), Benzenesulfonic acid, [(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis[imino(3-methyl-3,1-propanediyl)]]bis-, disodium salt, Benzenesulfonic acid, [(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis[imino(3-methyl-3,1-propanediyl)]]bis-, sodium salt (1:2)
| Molecular Formula | C34H32N2Na2O8S2 |
|---|---|
| Molecular Weight | 706.14 g/mol |
| LogP | -1.4888 |
| Topological Polar Surface Area | 174.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 706.1395 |
| Heavy Atoms | 48 |
| Complexity | 1210.0 |
Chemical Identifiers
| CAS Number | 70900-27-5 |
|---|---|
| SMILES | CC(CCOS(=O)(=O)C1=CC=CC=C1)N=C2C=CC(=NC(C)CCOS(=O)(=O)C3=CC=CC=C3)C4=C(C5=CC=CC=C5C(=C24)[O-])[O-].[Na+].[Na+] |
| InChIKey | XLLPAZOAOXJSTQ-UHFFFAOYSA-L |
Product Overview
RefChem:563895 (CAS 70900-27-5), with molecular formula C34H32N2Na2O8S2 and molecular weight 706.14 g/mol. IUPAC: disodium;1,4-bis[4-(benzenesulfonyloxy)butan-2-ylimino]anthracene-9,10-diolate.
Chemical Property Profile of RefChem:563895
Property Insights of RefChem:563895
The XLogP value of -1.4888 indicates that RefChem:563895 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 174.0 Ų indicates high polarity, suggesting RefChem:563895 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:563895 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:563895?
The CAS number of RefChem:563895 is 70900-27-5.
What is the molecular formula of RefChem:563895?
The molecular formula of RefChem:563895 is C34H32N2Na2O8S2.
What is the molecular weight of RefChem:563895?
The molecular weight of RefChem:563895 is 706.14 g/mol.
Where can I buy RefChem:563895?
You can request a quote for RefChem:563895 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:563895?
Yes, KEHONG BIO provides custom synthesis services for RefChem:563895 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.