Boc-3-(3-pyridyl)-Ala-OH
TL;DR: Boc-3-(3-pyridyl)-Ala-OH (CAS 105454-25-9) is a chemical compound with molecular formula C13H18N2O4 and molecular weight 266.12665 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-3-ylpropanoic acid
Also Known As: Boc-L-3-Pyridylalanine, BOC-3-PAL-OH, Boc-3-(3-pyridyl)-L-alanine, Boc-L-3-(3-pyridyl)-alanine, Boc-3-(3-pyridyl)-alanine
Technical Specifications
| Molecular Formula | C13H18N2O4 |
| Molecular Weight | 266.12665 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 88.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 266.12665 Da |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CN=CC=C1)C(=O)O |
| InChIKey | JLBCSWWZSSVXRQ-JTQLQIEISA-N |
Chemical Property Profile of Boc-3-(3-pyridyl)-Ala-OH
Property Insights of Boc-3-(3-pyridyl)-Ala-OH
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-3-(3-pyridyl)-Ala-OH. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-3-(3-pyridyl)-Ala-OH. Following Lipinski's Rule of Five, Boc-3-(3-pyridyl)-Ala-OH has 2 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 Boc-3-(3-pyridyl)-Ala-OH?
The CAS number of Boc-3-(3-pyridyl)-Ala-OH is 105454-25-9.
What is the molecular formula of Boc-3-(3-pyridyl)-Ala-OH?
The molecular formula of Boc-3-(3-pyridyl)-Ala-OH is C13H18N2O4.
What is the molecular weight of Boc-3-(3-pyridyl)-Ala-OH?
The molecular weight of Boc-3-(3-pyridyl)-Ala-OH is 266.12665 g/mol.
Where can I buy Boc-3-(3-pyridyl)-Ala-OH?
You can request a quote for Boc-3-(3-pyridyl)-Ala-OH directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Boc-3-(3-pyridyl)-Ala-OH?
Yes, CoreyChem provides custom synthesis services for Boc-3-(3-pyridyl)-Ala-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.