5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate
TL;DR: 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate (CAS 105590-97-4) is a chemical compound with molecular formula C16H23NO4 and molecular weight 293.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate
Also Known As: AmbotzHAA1085, Deglutathin impurity 3, Glutamic acid impurity 5, 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate, (S)-5-Benzyl 1-tert-butyl 2-aminopentanedioate
| Molecular Formula | C16H23NO4 |
|---|---|
| Molecular Weight | 293.16 g/mol |
| LogP | 2.179 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 293.16272 |
| Heavy Atoms | 21 |
| Complexity | 464.91537 |
Chemical Identifiers
| CAS Number | 105590-97-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)[C@H](CCC(=O)OCC1=CC=CC=C1)N |
Product Overview
5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate (CAS 105590-97-4), with molecular formula C16H23NO4 and molecular weight 293.16 g/mol. IUPAC: 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate.
Chemical Property Profile of 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate
Property Insights of 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate
The XLogP value of 2.179 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate. The TPSA of 78.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate. Following Lipinski's Rule of Five, 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate has 1 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 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate?
The CAS number of 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate is 105590-97-4.
What is the molecular formula of 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate?
The molecular formula of 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate is C16H23NO4.
What is the molecular weight of 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate?
The molecular weight of 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate is 293.16 g/mol.
Where can I buy 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate?
You can request a quote for 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate?
Yes, KEHONG BIO provides custom synthesis services for 5-O-benzyl 1-O-tert-butyl (2S)-2-aminopentanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.