2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
TL;DR: 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one (CAS 6961-55-3) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-methyl-1-oxidopyridin-1-ium-2-yl)-1-phenylethanone
Also Known As: 2-(6-methyl-1-oxidopyridin-1-ium-2-yl)-1-phenylethanone, 2-(2-methyl-1-oxido-pyridin-6-yl)-1-phenyl-ethanone, Ethanone, 2-(6-methyl-1-oxido-2-pyridinyl)-1-phenyl-, 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
| Molecular Formula | C14H13NO2 |
|---|---|
| Molecular Weight | 227.09 g/mol |
| LogP | 2.05382 |
| Topological Polar Surface Area | 44.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.09464 |
| Heavy Atoms | 17 |
| Complexity | 535.1734 |
Chemical Identifiers
| CAS Number | 6961-55-3 |
|---|---|
| SMILES | CC1=[N+](C(=CC=C1)CC(=O)C2=CC=CC=C2)[O-] |
Product Overview
2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one (CAS 6961-55-3), with molecular formula C14H13NO2 and molecular weight 227.09 g/mol. IUPAC: 2-(6-methyl-1-oxidopyridin-1-ium-2-yl)-1-phenylethanone.
Chemical Property Profile of 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
Property Insights of 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one
The XLogP value of 2.05382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one. With a topological polar surface area (TPSA) of 44.01 Ų, 2-(6-Methyl-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-(6-Methyl-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-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
The CAS number of 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one is 6961-55-3.
What is the molecular formula of 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
The molecular formula of 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one is C14H13NO2.
What is the molecular weight of 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
The molecular weight of 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one is 227.09 g/mol.
Where can I buy 2-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
You can request a quote for 2-(6-Methyl-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-(6-Methyl-1-oxo-1lambda~5~-pyridin-2-yl)-1-phenylethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(6-Methyl-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.