![4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide structure](/static/products/2143/214359-40-7.webp)
4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide
TL;DR: 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide (CAS 214359-40-7) is a chemical compound with molecular formula C13H11ClN2S2 and molecular weight 294.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide
Also Known As: 4-[(4-chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide, J1.254.090F, 4-(4-Chlorobenzylthio)pyridine-2-carbothioamide, 4-(4-Chlorobenzylthio)-2-(thiocarbamoyl)pyridine, 2-Pyridinecarbothioamide, 4-[[(4-chlorophenyl)methyl]thio]-
| Molecular Formula | C13H11ClN2S2 |
|---|---|
| Molecular Weight | 294.01 g/mol |
| LogP | 3.6615 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.00522 |
| Heavy Atoms | 18 |
| Complexity | 555.1726 |
Chemical Identifiers
| CAS Number | 214359-40-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC2=CC(=NC=C2)C(=S)N)Cl |
Product Overview
4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide (CAS 214359-40-7), with molecular formula C13H11ClN2S2 and molecular weight 294.01 g/mol. IUPAC: 4-[(4-chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide.
Chemical Property Profile of 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide
Property Insights of 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide
The XLogP value of 3.6615 indicates that 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.91 Ų, 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide has 1 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 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide?
The CAS number of 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide is 214359-40-7.
What is the molecular formula of 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide?
The molecular formula of 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide is C13H11ClN2S2.
What is the molecular weight of 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide?
The molecular weight of 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide is 294.01 g/mol.
Where can I buy 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide?
You can request a quote for 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Chlorophenyl)methylsulfanyl]pyridine-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.