Boc-3-(4-pyridyl)-D-alanine
TL;DR: Boc-3-(4-pyridyl)-D-alanine (CAS 37535-57-2) is a chemical compound with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-4-ylpropanoic acid
Also Known As: Boc-D-4-Pal-OH, Boc-3-(4-pyridyl)-D-alanine, BOC-D-4-PYRIDYLALANINE, BOC-D-4-PYRIDYLALA, Boc-3-(4-pyridyl)-D-Ala-OH
| Molecular Formula | C13H18N2O4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 1.602 |
| Topological Polar Surface Area | 88.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.12665 |
| Heavy Atoms | 19 |
| Complexity | 439.70648 |
Chemical Identifiers
| CAS Number | 37535-57-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@H](CC1=CC=NC=C1)C(=O)O |
Product Overview
Boc-3-(4-pyridyl)-D-alanine (CAS 37535-57-2), with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol. IUPAC: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-4-ylpropanoic acid.
Chemical Property Profile of Boc-3-(4-pyridyl)-D-alanine
Property Insights of Boc-3-(4-pyridyl)-D-alanine
The XLogP value of 1.602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-3-(4-pyridyl)-D-alanine. The TPSA of 88.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-3-(4-pyridyl)-D-alanine. Following Lipinski's Rule of Five, Boc-3-(4-pyridyl)-D-alanine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Boc-3-(4-pyridyl)-D-alanine?
The CAS number of Boc-3-(4-pyridyl)-D-alanine is 37535-57-2.
What is the molecular formula of Boc-3-(4-pyridyl)-D-alanine?
The molecular formula of Boc-3-(4-pyridyl)-D-alanine is C13H18N2O4.
What is the molecular weight of Boc-3-(4-pyridyl)-D-alanine?
The molecular weight of Boc-3-(4-pyridyl)-D-alanine is 266.13 g/mol.
Where can I buy Boc-3-(4-pyridyl)-D-alanine?
You can request a quote for Boc-3-(4-pyridyl)-D-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-3-(4-pyridyl)-D-alanine?
Yes, KEHONG BIO provides custom synthesis services for Boc-3-(4-pyridyl)-D-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.