Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate
TL;DR: Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate (CAS 89820-08-6) is a chemical compound with molecular formula C19H21NO5S and molecular weight 375.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl]benzoate
Also Known As: Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate, Methyl 2-(oxiran-2-ylmethyl-(1-phenylethyl)sulfamoyl)benzoate, methyl 2-[(oxiran-2-ylmethyl)(1-phenylethyl)sulfamoyl]benzoate, methyl 2-[oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl]benzoate, Benzoic acid, 2-(((2-oxiranylmethyl)(1-phenylethyl)amino)sulfonyl)-, methyl ester
| Molecular Formula | C19H21NO5S |
|---|---|
| Molecular Weight | 375.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 375.11404 |
| Heavy Atoms | 26 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 89820-08-6 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)N(CC2CO2)S(=O)(=O)C3=CC=CC=C3C(=O)OC |
| InChIKey | JGPOEZNNTXYWAG-UHFFFAOYSA-N |
Product Overview
Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate (CAS 89820-08-6), with molecular formula C19H21NO5S and molecular weight 375.11 g/mol. IUPAC: methyl 2-[oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl]benzoate.
Chemical Property Profile of Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate
Property Insights of Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate. Following Lipinski's Rule of Five, Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate has 0 hydrogen bond donor(s) and 6 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 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate?
The CAS number of Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate is 89820-08-6.
What is the molecular formula of Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate?
The molecular formula of Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate is C19H21NO5S.
What is the molecular weight of Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate?
The molecular weight of Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate is 375.11 g/mol.
Where can I buy Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate?
You can request a quote for Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(oxiran-2-ylmethyl(1-phenylethyl)sulfamoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.