3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-
TL;DR: 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- (CAS 61856-50-6) is a chemical compound with molecular formula C14H13NOS and molecular weight 243.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethylphenyl)-2-sulfanylidenepyridine-3-carbaldehyde
Also Known As: 3-Formyl-1-(2,6-dimethylphenyl)-2(1H)-pyridinethione, 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-, AE-411/41415634, 1-(2,6-dimethylphenyl)-2-sulfanylidenepyridine-3-carbaldehyde, 1-(2,6-Dimethylphenyl)-2-thioxo-1,2-dihydropyridine-3-carbaldehyde
| Molecular Formula | C14H13NOS |
|---|---|
| Molecular Weight | 243.07 g/mol |
| LogP | 3.63613 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.0718 |
| Heavy Atoms | 17 |
| Complexity | 608.1096 |
Chemical Identifiers
| CAS Number | 61856-50-6 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N2C=CC=C(C2=S)C=O |
Product Overview
3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- (CAS 61856-50-6), with molecular formula C14H13NOS and molecular weight 243.07 g/mol. IUPAC: 1-(2,6-dimethylphenyl)-2-sulfanylidenepyridine-3-carbaldehyde.
Chemical Property Profile of 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-
Property Insights of 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-
The XLogP value of 3.63613 indicates that 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.0 Ų, 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- 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 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-?
The CAS number of 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- is 61856-50-6.
What is the molecular formula of 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-?
The molecular formula of 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- is C14H13NOS.
What is the molecular weight of 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-?
The molecular weight of 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- is 243.07 g/mol.
Where can I buy 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-?
You can request a quote for 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinecarboxaldehyde, 1-(2,6-dimethylphenyl)-1,2-dihydro-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.