TL;DR: Oleoylalanyl-alanyl-prolyl-valine amide (CAS 121258-38-6) is a chemical compound with molecular formula C34H61N5O5 and molecular weight 619.4673 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]-N-[(2S)-3-methyl-1-[[(Z)-octadec-9-enoyl]amino]-1-oxobutan-2-yl]pyrrolidine-2-carboxamide
Also Known As: Ol-Ala-ala-pro-val-NH2, Oleoylalanyl-alanyl-prolyl-valine amide, Oleoylalanyl-alanyl-prolyl-valinamide, (2S)-1-[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]-N-[(2S)-3-methyl-1-[[(Z)-octadec-9-enoyl]amino]-1-oxobutan-2-yl]pyrrolidine-2-carboxamide
| Molecular Formula | C34H61N5O5 |
| Molecular Weight | 619.4673 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 151.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 22 |
| Exact Mass | 619.4673 Da |
| Heavy Atoms | 44 |
| Complexity | 922.0 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](C)N |
| InChIKey | JPYFZHKSMACEQL-CBEAGQJSSA-N |
The XLogP value of 6.3 indicates that Oleoylalanyl-alanyl-prolyl-valine amide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting Oleoylalanyl-alanyl-prolyl-valine amide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Oleoylalanyl-alanyl-prolyl-valine amide has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Oleoylalanyl-alanyl-prolyl-valine amide is 121258-38-6.
The molecular formula of Oleoylalanyl-alanyl-prolyl-valine amide is C34H61N5O5.
The molecular weight of Oleoylalanyl-alanyl-prolyl-valine amide is 619.4673 g/mol.
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