3,4-Dimethoxyphenyl 2-pyridyl ketone
TL;DR: 3,4-Dimethoxyphenyl 2-pyridyl ketone (CAS 27693-42-1) is a chemical compound with molecular formula C14H13NO3 and molecular weight 243.08954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4-dimethoxyphenyl)-pyridin-2-ylmethanone
Also Known As: 2-(3,4-DIMETHOXYBENZOYL)PYRIDINE, 3,4-Dimethoxyphenyl 2-pyridyl ketone, (3,4-dimethoxyphenyl)(pyridin-2-yl)methanone, (3,4-dimethoxyphenyl)-pyridin-2-ylmethanone, KST-1A3466
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H13NO3 |
| Molecular Weight | 243.08954 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 48.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.08954 Da |
| Heavy Atoms | 18 |
| Complexity | 282.0 |
| SMILES | COC1=C(C=C(C=C1)C(=O)C2=CC=CC=N2)OC |
| InChIKey | CUTYZBYXXYWWHB-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dimethoxyphenyl 2-pyridyl ketone
Property Insights of 3,4-Dimethoxyphenyl 2-pyridyl ketone
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethoxyphenyl 2-pyridyl ketone. With a topological polar surface area (TPSA) of 48.4 Ų, 3,4-Dimethoxyphenyl 2-pyridyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethoxyphenyl 2-pyridyl ketone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,4-Dimethoxyphenyl 2-pyridyl ketone?
The CAS number of 3,4-Dimethoxyphenyl 2-pyridyl ketone is 27693-42-1.
What is the molecular formula of 3,4-Dimethoxyphenyl 2-pyridyl ketone?
The molecular formula of 3,4-Dimethoxyphenyl 2-pyridyl ketone is C14H13NO3.
What is the molecular weight of 3,4-Dimethoxyphenyl 2-pyridyl ketone?
The molecular weight of 3,4-Dimethoxyphenyl 2-pyridyl ketone is 243.08954 g/mol.
Where can I buy 3,4-Dimethoxyphenyl 2-pyridyl ketone?
You can request a quote for 3,4-Dimethoxyphenyl 2-pyridyl ketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dimethoxyphenyl 2-pyridyl ketone?
Yes, CoreyChem provides custom synthesis services for 3,4-Dimethoxyphenyl 2-pyridyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.