Levodopa 4-hydroxybutyl ester
TL;DR: Levodopa 4-hydroxybutyl ester (CAS 121770-19-2) is a chemical compound with molecular formula C13H19NO4 and molecular weight 253.13141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-3-(3-butoxy-4-hydroxyphenyl)propanoic acid
Also Known As: Levodopa 4-hydroxybutyl ester, 3-Butoxy-L-tyrosine, (2S)-2-amino-3-(3-butoxy-4-hydroxyphenyl)propanoic acid, (2R)-2-(Aminomethyl)-3-hydroxypropanoic acid, (2S)-2-amino-3-(3-butoxy-4-hydroxyphenyl)propanoicacid
Technical Specifications
| Molecular Formula | C13H19NO4 |
| Molecular Weight | 253.13141 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 92.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 253.13141 Da |
| Heavy Atoms | 18 |
| Complexity | 259.0 |
| SMILES | CCCCOC1=C(C=CC(=C1)C[C@@H](C(=O)O)N)O |
| InChIKey | XPKFGLSHFSMLRL-JTQLQIEISA-N |
Chemical Property Profile of Levodopa 4-hydroxybutyl ester
Property Insights of Levodopa 4-hydroxybutyl ester
The XLogP value of -1.2 indicates that Levodopa 4-hydroxybutyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Levodopa 4-hydroxybutyl ester. Following Lipinski's Rule of Five, Levodopa 4-hydroxybutyl ester has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Levodopa 4-hydroxybutyl ester?
The CAS number of Levodopa 4-hydroxybutyl ester is 121770-19-2.
What is the molecular formula of Levodopa 4-hydroxybutyl ester?
The molecular formula of Levodopa 4-hydroxybutyl ester is C13H19NO4.
What is the molecular weight of Levodopa 4-hydroxybutyl ester?
The molecular weight of Levodopa 4-hydroxybutyl ester is 253.13141 g/mol.
Where can I buy Levodopa 4-hydroxybutyl ester?
You can request a quote for Levodopa 4-hydroxybutyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Levodopa 4-hydroxybutyl ester?
Yes, CoreyChem provides custom synthesis services for Levodopa 4-hydroxybutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.