Aspartyl-2,3-methanoproline propyl ester
TL;DR: Aspartyl-2,3-methanoproline propyl ester (CAS 134732-59-5) is a chemical compound with molecular formula C13H20N2O5 and molecular weight 284.1372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-amino-4-oxo-4-[(1S)-1-propoxycarbonyl-2-azabicyclo[3.1.0]hexan-2-yl]butanoic acid
Also Known As: Asp-2,3-mepro-opr, Aspartyl-2,3-methanoproline propyl ester, aspartyl-2,3-methanoprolinepropylester, (3S)-3-amino-4-oxo-4-[(1S)-1-propoxycarbonyl-2-azabicyclo[3.1.0]hexan-2-yl]butanoic acid, (3S)-3-amino-4-oxo-4-[(5S)-5-propoxycarbonyl-4-azabicyclo[3.1.0]hexan-4-yl]butanoic acid
Technical Specifications
| Molecular Formula | C13H20N2O5 |
| Molecular Weight | 284.1372 g/mol |
| XLogP | -2.7 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 284.1372 Da |
| Heavy Atoms | 20 |
| Complexity | 438.0 |
| SMILES | CCCOC(=O)[C@]12CC1CCN2C(=O)[C@H](CC(=O)O)N |
| InChIKey | SNJZXFDYOLIBOC-JDRUZZMFSA-N |
Chemical Property Profile of Aspartyl-2,3-methanoproline propyl ester
Property Insights of Aspartyl-2,3-methanoproline propyl ester
The XLogP value of -2.7 indicates that Aspartyl-2,3-methanoproline propyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aspartyl-2,3-methanoproline propyl ester. Following Lipinski's Rule of Five, Aspartyl-2,3-methanoproline propyl ester has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Aspartyl-2,3-methanoproline propyl ester?
The CAS number of Aspartyl-2,3-methanoproline propyl ester is 134732-59-5.
What is the molecular formula of Aspartyl-2,3-methanoproline propyl ester?
The molecular formula of Aspartyl-2,3-methanoproline propyl ester is C13H20N2O5.
What is the molecular weight of Aspartyl-2,3-methanoproline propyl ester?
The molecular weight of Aspartyl-2,3-methanoproline propyl ester is 284.1372 g/mol.
Where can I buy Aspartyl-2,3-methanoproline propyl ester?
You can request a quote for Aspartyl-2,3-methanoproline propyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aspartyl-2,3-methanoproline propyl ester?
Yes, CoreyChem provides custom synthesis services for Aspartyl-2,3-methanoproline propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.