(2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid
TL;DR: (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid (CAS 1259990-33-4) is a chemical compound with molecular formula C14H18BrNO4 and molecular weight 343.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-(2-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: BOC-PHE(2-BR)-OH, Boc-L-2-Bromophenylalanine, Boc-2-bromo-L-phenylalanine, (S)-N-Boc-2-Bromophenylalanine, Boc-D-2-Bromophenylalanine
| Molecular Formula | C14H18BrNO4 |
|---|---|
| Molecular Weight | 343.04 g/mol |
| LogP | 2.9695 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.04193 |
| Heavy Atoms | 20 |
| Complexity | 496.1924 |
Chemical Identifiers
| CAS Number | 1259990-33-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1Br)C(=O)O |
Product Overview
(2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid (CAS 1259990-33-4), with molecular formula C14H18BrNO4 and molecular weight 343.04 g/mol. IUPAC: (2S)-3-(2-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
Chemical Property Profile of (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid
Property Insights of (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid
The XLogP value of 2.9695 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid. Following Lipinski's Rule of Five, (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid has 2 hydrogen bond donor(s) and 3 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 (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid?
The CAS number of (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid is 1259990-33-4.
What is the molecular formula of (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid?
The molecular formula of (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid is C14H18BrNO4.
What is the molecular weight of (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid?
The molecular weight of (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid is 343.04 g/mol.
Where can I buy (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid?
You can request a quote for (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-3-(2-bromophenyl)-2-(((tert-butoxy)carbonyl)amino)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.