TL;DR: H-Leu-DL-Glu-DL-Asp-Gly-Pro-Lys-Phe-Leu-OH (CAS 107489-37-2) is a chemical compound with molecular formula C43H67N9O13 and molecular weight 917.48584 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-1-[2-[[2-[[2-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-3-carboxypropanoyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
Also Known As: Thymoctonan, THF-gamma2, Thymoctonan [INN], Thymic humoral factor gamma 2, Leu-Glu-Asp-Gly-Pro-Lys-Phe-Leu
| Molecular Formula | C43H67N9O13 |
| Molecular Weight | 917.48584 g/mol |
| XLogP | -4.5 |
| Topological Polar Surface Area (TPSA) | 359.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 29 |
| Exact Mass | 917.48584 Da |
| Heavy Atoms | 65 |
| Complexity | 1660.0 |
| SMILES | CC(C)C[C@@H](C(=O)NC(CCC(=O)O)C(=O)NC(CC(=O)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC(C)C)C(=O)O)N |
| InChIKey | NYJVPTKMDYSZDU-ABOUQVDVSA-N |
The XLogP value of -4.5 indicates that H-Leu-DL-Glu-DL-Asp-Gly-Pro-Lys-Phe-Leu-OH is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 359.0 Ų indicates high polarity, suggesting H-Leu-DL-Glu-DL-Asp-Gly-Pro-Lys-Phe-Leu-OH may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, H-Leu-DL-Glu-DL-Asp-Gly-Pro-Lys-Phe-Leu-OH has 11 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of H-Leu-DL-Glu-DL-Asp-Gly-Pro-Lys-Phe-Leu-OH is 107489-37-2.
The molecular formula of H-Leu-DL-Glu-DL-Asp-Gly-Pro-Lys-Phe-Leu-OH is C43H67N9O13.
The molecular weight of H-Leu-DL-Glu-DL-Asp-Gly-Pro-Lys-Phe-Leu-OH is 917.48584 g/mol.
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