2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one
TL;DR: 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one (CAS 38025-71-7) is a chemical compound with molecular formula C14H17NO2 and molecular weight 231.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-6-hydroxy-2-azabicyclo[2.2.2]octan-3-one
Also Known As: 2-benzyl-6-hydroxy-2-azabicyclo[2.2.2]octan-3-one, Maybridge1_002486, ChemDiv2_001054, DivK1c_001238, CDS1_000198
| Molecular Formula | C14H17NO2 |
|---|---|
| Molecular Weight | 231.13 g/mol |
| LogP | 1.5584 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.12593 |
| Heavy Atoms | 17 |
| Complexity | 417.4902 |
Chemical Identifiers
| CAS Number | 38025-71-7 |
|---|---|
| SMILES | C1CC2C(CC1C(=O)N2CC3=CC=CC=C3)O |
Product Overview
2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one (CAS 38025-71-7), with molecular formula C14H17NO2 and molecular weight 231.13 g/mol. IUPAC: 2-benzyl-6-hydroxy-2-azabicyclo[2.2.2]octan-3-one.
Chemical Property Profile of 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one
Property Insights of 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one
The XLogP value of 1.5584 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one. With a topological polar surface area (TPSA) of 40.54 Ų, 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one has 1 hydrogen bond donor(s) and 2 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-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one?
The CAS number of 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one is 38025-71-7.
What is the molecular formula of 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one?
The molecular formula of 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one is C14H17NO2.
What is the molecular weight of 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one?
The molecular weight of 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one is 231.13 g/mol.
Where can I buy 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one?
You can request a quote for 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-6-hydroxy-2-azabicyclo(2.2.2)octan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.