TL;DR: 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid (CAS 104941-55-1) is a chemical compound with molecular formula C15H15NO4S and molecular weight 305.07217 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic acid
Also Known As: 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid, 2-Methyl-5-(N-(o-tolyl)sulfamoyl)benzoic acid, 2-[(2-chlorobenzoyl)amino]-4-(methylsulfonyl)butanoic acid, 2-methyl-5-{[(2-methylphenyl)amino]sulfonyl}benzoic acid, 2-methyl-5-(o-tolylsulfamoyl)benzoic acid
| Molecular Formula | C15H15NO4S |
| Molecular Weight | 305.07217 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.07217 Da |
| Heavy Atoms | 21 |
| Complexity | 471.0 |
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C)C(=O)O |
| InChIKey | JRNVPZSAURGQIX-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid. Following Lipinski's Rule of Five, 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid is 104941-55-1.
The molecular formula of 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid is C15H15NO4S.
The molecular weight of 2-methyl-5-[(2-methylphenyl)sulfamoyl]benzoic Acid is 305.07217 g/mol.
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