2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate
TL;DR: 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate (CAS 40805-94-5) is a chemical compound with molecular formula C16H23NO3 and molecular weight 277.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ylethyl 3-hydroxy-2-phenylpropanoate
Also Known As: 2-(piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate, 3-Hydroxy-2-phenylpropionic acid 2-piperidinoethyl ester, 2-20-00-00019 (Beilstein Handbook Reference), 2-piperidin-1-ylethyl 3-hydroxy-2-phenylpropanoate, Propionic acid, 3-hydroxy-2-phenyl-, 2-piperidinoethyl ester
| Molecular Formula | C16H23NO3 |
|---|---|
| Molecular Weight | 277.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 277.1678 |
| Heavy Atoms | 20 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 40805-94-5 |
|---|---|
| SMILES | C1CCN(CC1)CCOC(=O)C(CO)C2=CC=CC=C2 |
| InChIKey | NKUNZZUYPXZYBM-UHFFFAOYSA-N |
Product Overview
2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate (CAS 40805-94-5), with molecular formula C16H23NO3 and molecular weight 277.17 g/mol. IUPAC: 2-piperidin-1-ylethyl 3-hydroxy-2-phenylpropanoate.
Chemical Property Profile of 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate
Property Insights of 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate. With a topological polar surface area (TPSA) of 49.8 Ų, 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate 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-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate?
The CAS number of 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate is 40805-94-5.
What is the molecular formula of 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate?
The molecular formula of 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate is C16H23NO3.
What is the molecular weight of 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate?
The molecular weight of 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate is 277.17 g/mol.
Where can I buy 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate?
You can request a quote for 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Piperidin-1-yl)ethyl 3-hydroxy-2-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.