TL;DR: L-3,4-(dioxyphenylacetyl)phenylalanine (CAS 120382-00-5) is a chemical compound with molecular formula C25H23NO6 and molecular weight 433.15253 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-3-[3,4-bis[(2-phenylacetyl)oxy]phenyl]propanoic acid
Also Known As: 3,4-Diphenylacetyl-L-dopa, L-3,4-(Dioxyphenylacetyl)phenylalanine, (2S)-2-amino-3-[3,4-bis[(2-phenylacetyl)oxy]phenyl]propanoic acid, O-(Phenylacetyl)-3-[(phenylacetyl)oxy]tyrosine, O-(Phenylacetyl)-3-[(phenylacetyl)oxy]-L-tyrosine
| Molecular Formula | C25H23NO6 |
| Molecular Weight | 433.15253 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 433.15253 Da |
| Heavy Atoms | 32 |
| Complexity | 626.0 |
| SMILES | C1=CC=C(C=C1)CC(=O)OC2=C(C=C(C=C2)C[C@@H](C(=O)O)N)OC(=O)CC3=CC=CC=C3 |
| InChIKey | VTESKZKKFZZIOB-FQEVSTJZSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-3,4-(dioxyphenylacetyl)phenylalanine. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for L-3,4-(dioxyphenylacetyl)phenylalanine. Following Lipinski's Rule of Five, L-3,4-(dioxyphenylacetyl)phenylalanine has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of L-3,4-(dioxyphenylacetyl)phenylalanine is 120382-00-5.
The molecular formula of L-3,4-(dioxyphenylacetyl)phenylalanine is C25H23NO6.
The molecular weight of L-3,4-(dioxyphenylacetyl)phenylalanine is 433.15253 g/mol.
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