2-Phenylethyl 5-amino-4-oxopentanoate
TL;DR: 2-Phenylethyl 5-amino-4-oxopentanoate (CAS 163271-26-9) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 5-amino-4-oxopentanoate
Also Known As: 2-PHENYLETHYL 5-AMINO-4-OXOPENTANOATE, Phenethyl 5-amino-4-oxo-pentanoate, 4-Oxo-5-aminopentanoic acid phenethyl ester, Pentanoic acid, 5-amino-4-oxo-, 2-phenylethyl ester, J1.058.799I
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.0803 |
| Topological Polar Surface Area | 69.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 362.18713 |
Chemical Identifiers
| CAS Number | 163271-26-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCOC(=O)CCC(=O)CN |
Product Overview
2-Phenylethyl 5-amino-4-oxopentanoate (CAS 163271-26-9), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: 2-phenylethyl 5-amino-4-oxopentanoate.
Chemical Property Profile of 2-Phenylethyl 5-amino-4-oxopentanoate
Property Insights of 2-Phenylethyl 5-amino-4-oxopentanoate
The XLogP value of 1.0803 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenylethyl 5-amino-4-oxopentanoate. The TPSA of 69.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Phenylethyl 5-amino-4-oxopentanoate. Following Lipinski's Rule of Five, 2-Phenylethyl 5-amino-4-oxopentanoate has 1 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 2-Phenylethyl 5-amino-4-oxopentanoate?
The CAS number of 2-Phenylethyl 5-amino-4-oxopentanoate is 163271-26-9.
What is the molecular formula of 2-Phenylethyl 5-amino-4-oxopentanoate?
The molecular formula of 2-Phenylethyl 5-amino-4-oxopentanoate is C13H17NO3.
What is the molecular weight of 2-Phenylethyl 5-amino-4-oxopentanoate?
The molecular weight of 2-Phenylethyl 5-amino-4-oxopentanoate is 235.12 g/mol.
Where can I buy 2-Phenylethyl 5-amino-4-oxopentanoate?
You can request a quote for 2-Phenylethyl 5-amino-4-oxopentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenylethyl 5-amino-4-oxopentanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenylethyl 5-amino-4-oxopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.