TL;DR: 4-Methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid (CAS 150050-20-7) is a chemical compound with molecular formula C14H16Cl3NO4 and molecular weight 367.0145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid
Also Known As: n-[(2,4,5-trichlorophenoxy)acetyl]leucine, N-((2,4,5-Trichlorophenoxy)acetyl)-L-leucine, 4-methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid
| Molecular Formula | C14H16Cl3NO4 |
| Molecular Weight | 367.0145 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.0145 Da |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
| SMILES | CC(C)CC(C(=O)O)NC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl |
| InChIKey | KSWCEGPKEFBTOX-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 4-Methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid. Following Lipinski's Rule of Five, 4-Methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid is 150050-20-7.
The molecular formula of 4-Methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid is C14H16Cl3NO4.
The molecular weight of 4-Methyl-2-[[2-(2,4,5-trichlorophenoxy)acetyl]amino]pentanoic acid is 367.0145 g/mol.
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