2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
TL;DR: 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one (CAS 61395-07-1) is a chemical compound with molecular formula C13H11NO2 and molecular weight 213.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-oxidopyridin-1-ium-2-yl)-1-phenylethanone
Also Known As: 2-(2-Oxo-2-phenylethyl)-pyridine N-oxide, 2-(1-oxidopyridin-1-ium-2-yl)-1-phenylethanone, 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
| Molecular Formula | C13H11NO2 |
|---|---|
| Molecular Weight | 213.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.07898 |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 61395-07-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CC2=CC=CC=[N+]2[O-] |
| InChIKey | GJQMUZLTOFMOHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one (CAS 61395-07-1), with molecular formula C13H11NO2 and molecular weight 213.08 g/mol. IUPAC: 2-(1-oxidopyridin-1-ium-2-yl)-1-phenylethanone.
Chemical Property Profile of 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
Property Insights of 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one. With a topological polar surface area (TPSA) of 42.5 Ų, 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one has 0 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-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
The CAS number of 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one is 61395-07-1.
What is the molecular formula of 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
The molecular formula of 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one is C13H11NO2.
What is the molecular weight of 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
The molecular weight of 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one is 213.08 g/mol.
Where can I buy 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
You can request a quote for 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.