1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one
TL;DR: 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one (CAS 1257535-04-8) is a chemical compound with molecular formula C14H14ClNO and molecular weight 247.07639 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one
Also Known As: Phenyl 2-fluoro-5-nitrobenzoate, 1-(3-chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one, 1-(3-chloro-4-methyl-phenyl)-2,6-dimethyl-pyridin-4-one
Technical Specifications
| Molecular Formula | C14H14ClNO |
| Molecular Weight | 247.07639 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.07639 Da |
| Heavy Atoms | 17 |
| Complexity | 364.0 |
| SMILES | CC1=C(C=C(C=C1)N2C(=CC(=O)C=C2C)C)Cl |
| InChIKey | PVWHZGPJJNDCMM-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one
Property Insights of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one
The XLogP value of 3.6 indicates that 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-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
What is the CAS number of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one?
The CAS number of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one is 1257535-04-8.
What is the molecular formula of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one?
The molecular formula of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one is C14H14ClNO.
What is the molecular weight of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one?
The molecular weight of 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one is 247.07639 g/mol.
Where can I buy 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one?
You can request a quote for 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one?
Yes, CoreyChem provides custom synthesis services for 1-(3-Chloro-4-methylphenyl)-2,6-dimethylpyridin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.