TL;DR: Methyldopa-phenylalanine (CAS 119933-71-0) is a chemical compound with molecular formula C19H22N2O5 and molecular weight 358.15286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[[(2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoyl]amino]-3-phenylpropanoic acid
Also Known As: Methyldopa-phenylalanine, alpha-Methyldopa-phe, .ALPHA.-METHYLDOPA-PHE, alpha-Methyl-3-hydroxy-L-Tyr-L-Phe-OH, L-Phenylalanine, N-(3-hydroxy-alpha-methyl-L-tyrosyl)-
| Molecular Formula | C19H22N2O5 |
| Molecular Weight | 358.15286 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 133.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.15286 Da |
| Heavy Atoms | 26 |
| Complexity | 494.0 |
| SMILES | C[C@](CC1=CC(=C(C=C1)O)O)(C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)N |
| InChIKey | BOIYMVUPSRYBCA-LIRRHRJNSA-N |
The XLogP value of -0.6 indicates that Methyldopa-phenylalanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyldopa-phenylalanine. Following Lipinski's Rule of Five, Methyldopa-phenylalanine has 5 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 Methyldopa-phenylalanine is 119933-71-0.
The molecular formula of Methyldopa-phenylalanine is C19H22N2O5.
The molecular weight of Methyldopa-phenylalanine is 358.15286 g/mol.
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