2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde
TL;DR: 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde (CAS 338982-28-8) is a chemical compound with molecular formula C12H8ClNOS and molecular weight 249.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfanylpyridine-3-carbaldehyde
Also Known As: 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde, 2-((4-Chlorophenyl)thio)nicotinaldehyde, 2-(4-chlorophenyl)sulfanylpyridine-3-carbaldehyde, 2-[(4-chlorophenyl)sulfanyl]pyridine-3-carbaldehyde, 3L-303S
| Molecular Formula | C12H8ClNOS |
|---|---|
| Molecular Weight | 249.00 g/mol |
| LogP | 3.6987 |
| Topological Polar Surface Area | 29.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.00151 |
| Heavy Atoms | 16 |
| Complexity | 498.62686 |
Chemical Identifiers
| CAS Number | 338982-28-8 |
|---|---|
| SMILES | C1=CC(=C(N=C1)SC2=CC=C(C=C2)Cl)C=O |
Product Overview
2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde (CAS 338982-28-8), with molecular formula C12H8ClNOS and molecular weight 249.00 g/mol. IUPAC: 2-(4-chlorophenyl)sulfanylpyridine-3-carbaldehyde.
Chemical Property Profile of 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde
Property Insights of 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde
The XLogP value of 3.6987 indicates that 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.96 Ų, 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde has 0 hydrogen bond donor(s) and 3 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-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde?
The CAS number of 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde is 338982-28-8.
What is the molecular formula of 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde?
The molecular formula of 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde is C12H8ClNOS.
What is the molecular weight of 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde?
The molecular weight of 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde is 249.00 g/mol.
Where can I buy 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde?
You can request a quote for 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Chlorophenyl)Sulfanyl]Nicotinaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.