Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester
TL;DR: Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester (CAS 70017-19-5) is a chemical compound with molecular formula C11H15NO5S and molecular weight 273.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-propan-2-yloxy-2-sulfamoylbenzoate
Also Known As: Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester, 5-Isopropoxy-2-sulfamidobenzoic acid 3-methyl ester, methyl 5-propan-2-yloxy-2-sulfamoylbenzoate, methyl 5-(propan-2-yloxy)-2-sulfamoylbenzoate, Benzoic acid, 2-(aminosulfonyl)-5-(1-methylethoxy)-, methyl ester
| Molecular Formula | C11H15NO5S |
|---|---|
| Molecular Weight | 273.07 g/mol |
| LogP | 0.9078 |
| Topological Polar Surface Area | 95.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.0671 |
| Heavy Atoms | 18 |
| Complexity | 550.55206 |
Chemical Identifiers
| CAS Number | 70017-19-5 |
|---|---|
| SMILES | CC(C)OC1=CC(=C(C=C1)S(=O)(=O)N)C(=O)OC |
Product Overview
Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester (CAS 70017-19-5), with molecular formula C11H15NO5S and molecular weight 273.07 g/mol. IUPAC: methyl 5-propan-2-yloxy-2-sulfamoylbenzoate.
Chemical Property Profile of Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester
Property Insights of Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester
The XLogP value of 0.9078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester. The TPSA of 95.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester. Following Lipinski's Rule of Five, Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester 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 Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester?
The CAS number of Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester is 70017-19-5.
What is the molecular formula of Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester?
The molecular formula of Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester is C11H15NO5S.
What is the molecular weight of Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester?
The molecular weight of Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester is 273.07 g/mol.
Where can I buy Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester?
You can request a quote for Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 5-isopropoxy-2-sulfamoyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.