Hepsulfam
TL;DR: Hepsulfam (CAS 96892-57-8) is a chemical compound with molecular formula C7H18N2O6S2 and molecular weight 290.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-sulfamoyloxyheptyl sulfamate
Also Known As: Hepsulfam, 1,7-Heptanediol disulfamate, 7-sulfamoyloxyheptyl sulfamate, heptane-1,7-diyl disulfamate, heptane-1,7-diyl bis(sulfamate)
| Molecular Formula | C7H18N2O6S2 |
|---|---|
| Molecular Weight | 290.06 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 290.06064 |
| Heavy Atoms | 17 |
| Complexity | 342.0 |
| Solubility | Water 3.6 - 2.7 (mg/mL) |
Chemical Identifiers
| CAS Number | 96892-57-8 |
|---|---|
| SMILES | C(CCCOS(=O)(=O)N)CCCOS(=O)(=O)N |
| InChIKey | GOJJWDOZNKBUSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hepsulfam (CAS 96892-57-8), with molecular formula C7H18N2O6S2 and molecular weight 290.06 g/mol. IUPAC: 7-sulfamoyloxyheptyl sulfamate.
Chemical Property Profile of Hepsulfam
Property Insights of Hepsulfam
The XLogP value of -0.3 indicates that Hepsulfam is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.0 Ų indicates high polarity, suggesting Hepsulfam may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hepsulfam has 2 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 Hepsulfam?
The CAS number of Hepsulfam is 96892-57-8.
What is the molecular formula of Hepsulfam?
The molecular formula of Hepsulfam is C7H18N2O6S2.
What is the molecular weight of Hepsulfam?
The molecular weight of Hepsulfam is 290.06 g/mol.
Where can I buy Hepsulfam?
You can request a quote for Hepsulfam directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hepsulfam?
Yes, KEHONG BIO provides custom synthesis services for Hepsulfam and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.