(S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate
TL;DR: (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate (CAS 190447-69-9) is a chemical compound with molecular formula C13H26N2O4 and molecular weight 274.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl (2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
Also Known As: Boc-L-dab-otBu HCl, BOC-DAB-OTBU HCL, BOC-DAB-OTBU, Boc-Dab-OtBu . HCl, BOC-DAB-OTBU Hydrochloride
| Molecular Formula | C13H26N2O4 |
|---|---|
| Molecular Weight | 274.19 g/mol |
| LogP | 1.5702 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.18927 |
| Heavy Atoms | 19 |
| Complexity | 315.58536 |
Chemical Identifiers
| CAS Number | 190447-69-9 |
|---|---|
| SMILES | CC(C)(C)OC(=O)[C@H](CCN)NC(=O)OC(C)(C)C |
Product Overview
(S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate (CAS 190447-69-9), with molecular formula C13H26N2O4 and molecular weight 274.19 g/mol. IUPAC: tert-butyl (2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate.
Chemical Property Profile of (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate
Property Insights of (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate
The XLogP value of 1.5702 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate. Following Lipinski's Rule of Five, (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate 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)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate?
The CAS number of (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate is 190447-69-9.
What is the molecular formula of (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate?
The molecular formula of (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate is C13H26N2O4.
What is the molecular weight of (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate?
The molecular weight of (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate is 274.19 g/mol.
Where can I buy (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate?
You can request a quote for (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-tert-Butyl 4-amino-2-((tert-butoxycarbonyl)amino)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.