Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
TL;DR: Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate (CAS 932303-37-2) is a chemical compound with molecular formula C18H17NO4S2 and molecular weight 375.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
Also Known As: ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate, VU0512186-1, ethyl 3-(N-(p-tolyl)sulfamoyl)benzo[b]thiophene-2-carboxylate, F3167-1229, ethyl 3-{[(4-methylphenyl)amino]sulfonyl}-1-benzothiophene-2-carboxylate
| Molecular Formula | C18H17NO4S2 |
|---|---|
| Molecular Weight | 375.06 g/mol |
| LogP | 4.18722 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.0599 |
| Heavy Atoms | 25 |
| Complexity | 1020.9156 |
Chemical Identifiers
| CAS Number | 932303-37-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)NC3=CC=C(C=C3)C |
Product Overview
Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate (CAS 932303-37-2), with molecular formula C18H17NO4S2 and molecular weight 375.06 g/mol. IUPAC: ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate.
Chemical Property Profile of Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
Property Insights of Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
The XLogP value of 4.18722 indicates that Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate 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 Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate?
The CAS number of Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate is 932303-37-2.
What is the molecular formula of Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate?
The molecular formula of Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate is C18H17NO4S2.
What is the molecular weight of Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate?
The molecular weight of Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate is 375.06 g/mol.
Where can I buy Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate?
You can request a quote for Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[(4-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.