TL;DR: Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl- (CAS 114364-72-6) is a chemical compound with molecular formula C17H18N2O2S and molecular weight 314.1089 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-indol-1-ylethyl)-4-methylbenzenesulfonamide
Also Known As: [2-(1-indolyl)ethyl]tosylamine, Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl-, F0613-0193, N-(2-indol-1-ylethyl)-4-methylbenzenesulfonamide, N-(2-(1H-indol-1-yl)ethyl)-4-methylbenzenesulfonamide
| Molecular Formula | C17H18N2O2S |
| Molecular Weight | 314.1089 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 59.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.1089 Da |
| Heavy Atoms | 22 |
| Complexity | 452.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCCN2C=CC3=CC=CC=C32 |
| InChIKey | GTJUZWWZYAJRTE-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.5 Ų, Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl- 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 Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl- is 114364-72-6.
The molecular formula of Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl- is C17H18N2O2S.
The molecular weight of Benzenesulfonamide, N-[2-(1H-indol-1-yl)ethyl]-4-methyl- is 314.1089 g/mol.
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