(S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid
TL;DR: (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid (CAS 161561-83-7) is a chemical compound with molecular formula C12H20N2O6 and molecular weight 288.13 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-(prop-2-enoxycarbonylamino)propanoic acid
Also Known As: BOC-DAP(ALOC)-OH, Boc-Dap(Alloc)-OH, Boc-L-Dap(Aloc)-OH, (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid, Boc-Dap(Alloc)-OH, AldrichCPR
| Molecular Formula | C12H20N2O6 |
|---|---|
| Molecular Weight | 288.13 g/mol |
| LogP | 0.8765 |
| Topological Polar Surface Area | 113.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 288.13214 |
| Heavy Atoms | 20 |
| Complexity | 374.63406 |
Chemical Identifiers
| CAS Number | 161561-83-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CNC(=O)OCC=C)C(=O)O |
Product Overview
(S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid (CAS 161561-83-7), with molecular formula C12H20N2O6 and molecular weight 288.13 g/mol. IUPAC: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(prop-2-enoxycarbonylamino)propanoic acid.
Chemical Property Profile of (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid
Property Insights of (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid
The XLogP value of 0.8765 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid. The TPSA of 113.96 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid. Following Lipinski's Rule of Five, (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid has 3 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)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid?
The CAS number of (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid is 161561-83-7.
What is the molecular formula of (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid?
The molecular formula of (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid is C12H20N2O6.
What is the molecular weight of (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid?
The molecular weight of (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid is 288.13 g/mol.
Where can I buy (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid?
You can request a quote for (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)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 (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-(((Allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.