(S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid
TL;DR: (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid (CAS 134107-69-0) is a chemical compound with molecular formula C11H16N2O4S and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1,3-thiazol-4-yl)propanoic acid
Also Known As: Boc-L-4-Thiazolylalanine, (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid, Boc-3-(4-Thiazolyl)-L-alanine, Boc-L-4-Thiazoylalanine, Boc-4-Thi-OH
| Molecular Formula | C11H16N2O4S |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 1.6635 |
| Topological Polar Surface Area | 88.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.08307 |
| Heavy Atoms | 18 |
| Complexity | 411.17773 |
Chemical Identifiers
| CAS Number | 134107-69-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CSC=N1)C(=O)O |
Product Overview
(S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid (CAS 134107-69-0), with molecular formula C11H16N2O4S and molecular weight 272.08 g/mol. IUPAC: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1,3-thiazol-4-yl)propanoic acid.
Chemical Property Profile of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid
Property Insights of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid
The XLogP value of 1.6635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid. The TPSA of 88.52 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid. Following Lipinski's Rule of Five, (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid 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
Frequently Asked Questions
What is the CAS number of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid?
The CAS number of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid is 134107-69-0.
What is the molecular formula of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid?
The molecular formula of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid is C11H16N2O4S.
What is the molecular weight of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid?
The molecular weight of (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid is 272.08 g/mol.
Where can I buy (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid?
You can request a quote for (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-((tert-Butoxycarbonyl)amino)-3-(thiazol-4-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.