2-Chloro-6-(ethylthio)-4-pyridinecarboxamide
TL;DR: 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide (CAS 31507-87-6) is a chemical compound with molecular formula C8H9ClN2OS and molecular weight 216.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6-ethylsulfanylpyridine-4-carboxamide
Also Known As: 2-chloro-6-(ethylthio)-4-pyridinecarboxamide, 2-chloro-6-(ethylsulfanyl)isonicotinamide, 2-Chloro-6-ethylthio-4-pyridinecarboxamide, 2-chloro-6-ethylsulfanylpyridine-4-carboxamide, 4-Pyridinecarboxamide,2-chloro-6-(ethylthio)-
| Molecular Formula | C8H9ClN2OS |
|---|---|
| Molecular Weight | 216.01 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 81.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.0124 |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 31507-87-6 |
|---|---|
| SMILES | CCSC1=NC(=CC(=C1)C(=O)N)Cl |
| InChIKey | JMUPTDNZAPEEEN-UHFFFAOYSA-N |
Product Overview
2-Chloro-6-(ethylthio)-4-pyridinecarboxamide (CAS 31507-87-6), with molecular formula C8H9ClN2OS and molecular weight 216.01 g/mol. IUPAC: 2-chloro-6-ethylsulfanylpyridine-4-carboxamide.
Chemical Property Profile of 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide
Property Insights of 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide. Following Lipinski's Rule of Five, 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide 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 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide?
The CAS number of 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide is 31507-87-6.
What is the molecular formula of 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide?
The molecular formula of 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide is C8H9ClN2OS.
What is the molecular weight of 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide?
The molecular weight of 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide is 216.01 g/mol.
Where can I buy 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide?
You can request a quote for 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-6-(ethylthio)-4-pyridinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.