RefChem:117919
TL;DR: RefChem:117919 (CAS 6826-44-4) is a chemical compound with molecular formula C15H10N2Na2O7S2 and molecular weight 439.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-[2-oxo-5-(4-sulfonatophenyl)-1,3-dihydroimidazol-4-yl]benzenesulfonate
Also Known As: Benzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, sodium salt (1:2), Benzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, disodium salt, Disodium p,p'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis(benzenesulphonate), disodium 4-[2-oxo-5-(4-sulfonatophenyl)-1,3-dihydroimidazol-4-yl]benzenesulfonate, disodium;4-[2-oxo-5-(4-sulfonatophenyl)-1,3-dihydroimidazol-4-yl]benzenesulfonate
| Molecular Formula | C15H10N2Na2O7S2 |
|---|---|
| Molecular Weight | 439.97 g/mol |
| LogP | -5.15 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 439.97247 |
| Heavy Atoms | 28 |
| Complexity | 699.0 |
Chemical Identifiers
| CAS Number | 6826-44-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(NC(=O)N2)C3=CC=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | APSHMRVPXPERJJ-UHFFFAOYSA-L |
Product Overview
RefChem:117919 (CAS 6826-44-4), with molecular formula C15H10N2Na2O7S2 and molecular weight 439.97 g/mol. IUPAC: disodium;4-[2-oxo-5-(4-sulfonatophenyl)-1,3-dihydroimidazol-4-yl]benzenesulfonate.
Chemical Property Profile of RefChem:117919
Property Insights of RefChem:117919
The XLogP value of -5.15 indicates that RefChem:117919 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 172.0 Ų indicates high polarity, suggesting RefChem:117919 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:117919 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 RefChem:117919?
The CAS number of RefChem:117919 is 6826-44-4.
What is the molecular formula of RefChem:117919?
The molecular formula of RefChem:117919 is C15H10N2Na2O7S2.
What is the molecular weight of RefChem:117919?
The molecular weight of RefChem:117919 is 439.97 g/mol.
Where can I buy RefChem:117919?
You can request a quote for RefChem:117919 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:117919?
Yes, KEHONG BIO provides custom synthesis services for RefChem:117919 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.