3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine
TL;DR: 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine (CAS 127581-38-8) is a chemical compound with molecular formula C13H8Cl2N2 and molecular weight 262.00644 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,6-dichloro-2-methyl-5-phenylpyridine-3-carbonitrile
Also Known As: 4,6-dichloro-2-methyl-5-phenylnicotinonitrile, 3-CYANO-4,6-DICHLORO-2-METHYL-5-PHENYLPYRIDINE, 4,6-dichloro-2-methyl-5-phenylpyridine-3-carbonitrile, AE-406/41056469, 4,6-dichloro-2-methyl-5-phenyl-3-pyridinecarbonitrile
Technical Specifications
| Molecular Formula | C13H8Cl2N2 |
| Molecular Weight | 262.00644 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 36.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 262.00644 Da |
| Heavy Atoms | 17 |
| Complexity | 306.0 |
| SMILES | CC1=C(C(=C(C(=N1)Cl)C2=CC=CC=C2)Cl)C#N |
| InChIKey | ULLSLRUDINNQOL-UHFFFAOYSA-N |
Chemical Property Profile of 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine
Property Insights of 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine
The XLogP value of 4.2 indicates that 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.7 Ų, 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine 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 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine?
The CAS number of 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine is 127581-38-8.
What is the molecular formula of 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine?
The molecular formula of 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine is C13H8Cl2N2.
What is the molecular weight of 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine?
The molecular weight of 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine is 262.00644 g/mol.
Where can I buy 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine?
You can request a quote for 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine?
Yes, CoreyChem provides custom synthesis services for 3-Cyano-4,6-dichloro-2-methyl-5-phenylpyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.