tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate
TL;DR: tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate (CAS 204587-95-1) is a chemical compound with molecular formula C14H21NO3 and molecular weight 251.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate
Also Known As: tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate, (2S,3R)-TERT-BUTYL 3-AMINO-2-HYDROXY-4-PHENYLBUTANOATE, Tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenyl-butanoate, TERT-BUTYL (2S,3R)-3-AMINO-2-HYDROXY-4-PHENYLBUTAN, (2R,3S)-TERT-BUTYL 3-AMINO-2-HYDROXY-4-PHENYLBUTANOATE
| Molecular Formula | C14H21NO3 |
|---|---|
| Molecular Weight | 251.15 g/mol |
| LogP | 1.259 |
| Topological Polar Surface Area | 72.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.15215 |
| Heavy Atoms | 18 |
| Complexity | 383.7756 |
Chemical Identifiers
| CAS Number | 204587-95-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)[C@H]([C@@H](CC1=CC=CC=C1)N)O |
Product Overview
tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate (CAS 204587-95-1), with molecular formula C14H21NO3 and molecular weight 251.15 g/mol. IUPAC: tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate.
Chemical Property Profile of tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate
Property Insights of tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate
The XLogP value of 1.259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate. The TPSA of 72.55 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate. Following Lipinski's Rule of Five, tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate 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 tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate?
The CAS number of tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate is 204587-95-1.
What is the molecular formula of tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate?
The molecular formula of tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate is C14H21NO3.
What is the molecular weight of tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate?
The molecular weight of tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate is 251.15 g/mol.
Where can I buy tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate?
You can request a quote for tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl (2S,3R)-3-amino-2-hydroxy-4-phenylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.