TL;DR: [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate (CAS 5721-50-6) is a chemical compound with molecular formula C24H20N2O5S and molecular weight 448.10928 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate
Also Known As: [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate|2-(1H-Indol-3-yl)-2-oxoethyl 4-[methyl(phenyl)sulfamoyl]benzoate|[2-(1H-indol-3-yl)-2-oxo-ethyl] 4-(methyl-phenyl-sulfamoyl)benzoate|AC1MAWF8
| Molecular Formula | C24H20N2O5S |
| Molecular Weight | 448.10928 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 448.10928 Da |
| Heavy Atoms | 32 |
| Complexity | 766.0 |
| SMILES | CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CNC4=CC=CC=C43 |
| InChIKey | LAMWKKCXIIHBNQ-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate. Following Lipinski's Rule of Five, [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate is 5721-50-6.
The molecular formula of [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate is C24H20N2O5S.
The molecular weight of [2-(1H-indol-3-yl)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate is 448.10928 g/mol.
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