N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide
TL;DR: N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide (CAS 104857-16-1) is a chemical compound with molecular formula C12H10N2OS and molecular weight 230.05139 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide
Also Known As: N-(phenyl)-1,2-dihydro-2-thioxo-3-pyridinecarboxamide, N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide
Technical Specifications
| Molecular Formula | C12H10N2OS |
| Molecular Weight | 230.05139 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 73.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.05139 Da |
| Heavy Atoms | 16 |
| Complexity | 354.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)C2=CC=CNC2=S |
| InChIKey | WBUBLAUPLDCCKU-UHFFFAOYSA-N |
Chemical Property Profile of N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide
Property Insights of N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide. Following Lipinski's Rule of Five, N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide has 2 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 N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide?
The CAS number of N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide is 104857-16-1.
What is the molecular formula of N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide?
The molecular formula of N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide is C12H10N2OS.
What is the molecular weight of N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide?
The molecular weight of N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide is 230.05139 g/mol.
Where can I buy N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide?
You can request a quote for N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide?
Yes, CoreyChem provides custom synthesis services for N-phenyl-2-sulfanylidene-1H-pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.