Iem 967
TL;DR: Iem 967 (CAS 109727-22-2) is a chemical compound with molecular formula C18H10Na2O8S3 and molecular weight 495.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;5,5-dioxo-7-(4-sulfonatophenyl)dibenzothiophene-3-sulfonate
Also Known As: Iem 967, 4,4'-Disulfo-p-terphenyl sulfone, 4,4'-Disulfo-p-terphenyl sulfone disodium salt, 7-p-Sulfophenyl-3-dibenzothiophenesulfonic acid 5,5-dioxide, disodium salt, disodium 5,5-dioxo-7-(4-sulfonatophenyl)dibenzothiophene-3-sulfonate
| Molecular Formula | C18H10Na2O8S3 |
|---|---|
| Molecular Weight | 495.93 g/mol |
| LogP | -4.017 |
| Topological Polar Surface Area | 174.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 495.93332 |
| Heavy Atoms | 31 |
| Complexity | 904.0 |
Chemical Identifiers
| CAS Number | 109727-22-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC3=C(C=C2)C4=C(S3(=O)=O)C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | OSJIIFUVNKDSEQ-UHFFFAOYSA-L |
Product Overview
Iem 967 (CAS 109727-22-2), with molecular formula C18H10Na2O8S3 and molecular weight 495.93 g/mol. IUPAC: disodium;5,5-dioxo-7-(4-sulfonatophenyl)dibenzothiophene-3-sulfonate.
Chemical Property Profile of Iem 967
Property Insights of Iem 967
The XLogP value of -4.017 indicates that Iem 967 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 174.0 Ų indicates high polarity, suggesting Iem 967 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Iem 967 has 0 hydrogen bond donor(s) and 8 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 Iem 967?
The CAS number of Iem 967 is 109727-22-2.
What is the molecular formula of Iem 967?
The molecular formula of Iem 967 is C18H10Na2O8S3.
What is the molecular weight of Iem 967?
The molecular weight of Iem 967 is 495.93 g/mol.
Where can I buy Iem 967?
You can request a quote for Iem 967 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iem 967?
Yes, KEHONG BIO provides custom synthesis services for Iem 967 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.