Methyl 4-sulphamoylbenzoate
TL;DR: Methyl 4-sulphamoylbenzoate (CAS 22808-73-7) is a chemical compound with molecular formula C8H9NO4S and molecular weight 215.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-sulfamoylbenzoate
Also Known As: methyl 4-sulfamoylbenzoate, Methyl 4-sulphamoylbenzoate, Methyl p-sulfamylbenzoate, methyl4-sulfamoylbenzoate, Methyl 4-(aminosulfonyl)benzoate
| Molecular Formula | C8H9NO4S |
|---|---|
| Molecular Weight | 215.03 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.02522 |
| Heavy Atoms | 14 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 22808-73-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)S(=O)(=O)N |
| InChIKey | XLOVNJUCAFIANM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-sulphamoylbenzoate (CAS 22808-73-7), with molecular formula C8H9NO4S and molecular weight 215.03 g/mol. IUPAC: methyl 4-sulfamoylbenzoate.
Chemical Property Profile of Methyl 4-sulphamoylbenzoate
Property Insights of Methyl 4-sulphamoylbenzoate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-sulphamoylbenzoate. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-sulphamoylbenzoate. Following Lipinski's Rule of Five, Methyl 4-sulphamoylbenzoate has 1 hydrogen bond donor(s) and 5 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 Methyl 4-sulphamoylbenzoate?
The CAS number of Methyl 4-sulphamoylbenzoate is 22808-73-7.
What is the molecular formula of Methyl 4-sulphamoylbenzoate?
The molecular formula of Methyl 4-sulphamoylbenzoate is C8H9NO4S.
What is the molecular weight of Methyl 4-sulphamoylbenzoate?
The molecular weight of Methyl 4-sulphamoylbenzoate is 215.03 g/mol.
Where can I buy Methyl 4-sulphamoylbenzoate?
You can request a quote for Methyl 4-sulphamoylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-sulphamoylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-sulphamoylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.