TL;DR: ((2-Fluorophenyl)sulfonyl)leucine (CAS 1041437-98-2) is a chemical compound with molecular formula C12H16FNO4S and molecular weight 289.0784 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-fluorophenyl)sulfonylamino]-4-methylpentanoic acid
Also Known As: ((2-fluorophenyl)sulfonyl)leucine, ((2-Fluorophenyl)sulfonyl)-L-leucine, 2-(2-fluorobenzenesulfonamido)-4-methylpentanoic acid, 2-[(2-fluorophenyl)sulfonylamino]-4-methylpentanoic acid, N-[(2-FLUOROPHENYL)SULFONYL]LEUCINE
| Molecular Formula | C12H16FNO4S |
| Molecular Weight | 289.0784 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 289.0784 Da |
| Heavy Atoms | 19 |
| Complexity | 404.0 |
| SMILES | CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=CC=C1F |
| InChIKey | DNXZNZQLHQZNLP-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((2-Fluorophenyl)sulfonyl)leucine. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for ((2-Fluorophenyl)sulfonyl)leucine. Following Lipinski's Rule of Five, ((2-Fluorophenyl)sulfonyl)leucine has 2 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-Fluorophenyl)sulfonyl)leucine is 1041437-98-2.
The molecular formula of ((2-Fluorophenyl)sulfonyl)leucine is C12H16FNO4S.
The molecular weight of ((2-Fluorophenyl)sulfonyl)leucine is 289.0784 g/mol.
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