TL;DR: H-Ala-His-Ala-OH (CAS 146321-25-7) is a chemical compound with molecular formula C12H19N5O4 and molecular weight 297.1437 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoic acid
Also Known As: H-Ala-His-Ala-OH, Ala-His-Ala, Alanyl-histidyl-alanine, L-Alanyl-L-histidyl-L-alanine, H-Ala-His-Ala-OH acetate salt
| Molecular Formula | C12H19N5O4 |
| Molecular Weight | 297.1437 g/mol |
| XLogP | -3.1 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 297.1437 Da |
| Heavy Atoms | 21 |
| Complexity | 398.0 |
| SMILES | C[C@@H](C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](C)C(=O)O)N |
| InChIKey | JDIQCVUDDFENPU-ZKWXMUAHSA-N |
The XLogP value of -3.1 indicates that H-Ala-His-Ala-OH is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting H-Ala-His-Ala-OH may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, H-Ala-His-Ala-OH has 4 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 H-Ala-His-Ala-OH is 146321-25-7.
The molecular formula of H-Ala-His-Ala-OH is C12H19N5O4.
The molecular weight of H-Ala-His-Ala-OH is 297.1437 g/mol.
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