TL;DR: N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine (CAS 117309-38-3) 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-[N-(benzenesulfonyl)-4-methylanilino]acetic acid
Also Known As: N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine, (Benzenesulfonyl-p-tolyl-amino)-acetic acid, glycine, N-(4-methylphenyl)-N-(phenylsulfonyl)-, N-(phenylsulfonyl)-N-(p-tolyl)glycine, (4-Methyl(phenylsulfonyl)anilino)acetic acid
| Molecular Formula | C15H15NO4S |
| Molecular Weight | 305.07217 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.07217 Da |
| Heavy Atoms | 21 |
| Complexity | 443.0 |
| SMILES | CC1=CC=C(C=C1)N(CC(=O)O)S(=O)(=O)C2=CC=CC=C2 |
| InChIKey | OQSZDEQZBBOCCP-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine. Following Lipinski's Rule of Five, N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine has 1 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 N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine is 117309-38-3.
The molecular formula of N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine is C15H15NO4S.
The molecular weight of N-(4-Methylphenyl)-N-(phenylsulfonyl)glycine is 305.07217 g/mol.
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