TL;DR: p-Toluenesulfonamide, N-benzyl- (CAS 1576-37-0) is a chemical compound with molecular formula C14H15NO2S and molecular weight 261.08234 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-4-methylbenzenesulfonamide
Also Known As: N-Benzyl-p-toluenesulfonamide, N-Tosylbenzylamine, Tosylbenzylamine, N-Benzyl-4-methylbenzenesulfonamide, BnNHTs
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H15NO2S |
| Molecular Weight | 261.08234 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.08234 Da |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
| Solubility | 25.9 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2 |
| InChIKey | WTHKAJZQYNKTCJ-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Toluenesulfonamide, N-benzyl-. With a topological polar surface area (TPSA) of 54.6 Ų, p-Toluenesulfonamide, N-benzyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Toluenesulfonamide, N-benzyl- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of p-Toluenesulfonamide, N-benzyl- is 1576-37-0.
The molecular formula of p-Toluenesulfonamide, N-benzyl- is C14H15NO2S.
The molecular weight of p-Toluenesulfonamide, N-benzyl- is 261.08234 g/mol.
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