6-(Phenyliminomethyl)pyridine-2-carbothioamide
TL;DR: 6-(Phenyliminomethyl)pyridine-2-carbothioamide (CAS 78797-13-4) is a chemical compound with molecular formula C13H11N3S and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(phenyliminomethyl)pyridine-2-carbothioamide
Also Known As: 6-(phenyliminomethyl)pyridine-2-carbothioamide, 2-Pyridinecarbothioamide,6-[(phenylimino)methyl]-, 6-[(E)-(Phenylimino)methyl]pyridine-2-carbothioamide
| Molecular Formula | C13H11N3S |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 2.4664 |
| Topological Polar Surface Area | 51.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.06737 |
| Heavy Atoms | 17 |
| Complexity | 549.6008 |
Chemical Identifiers
| CAS Number | 78797-13-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=CC2=NC(=CC=C2)C(=S)N |
Product Overview
6-(Phenyliminomethyl)pyridine-2-carbothioamide (CAS 78797-13-4), with molecular formula C13H11N3S and molecular weight 241.07 g/mol. IUPAC: 6-(phenyliminomethyl)pyridine-2-carbothioamide.
Chemical Property Profile of 6-(Phenyliminomethyl)pyridine-2-carbothioamide
Property Insights of 6-(Phenyliminomethyl)pyridine-2-carbothioamide
The XLogP value of 2.4664 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Phenyliminomethyl)pyridine-2-carbothioamide. With a topological polar surface area (TPSA) of 51.27 Ų, 6-(Phenyliminomethyl)pyridine-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(Phenyliminomethyl)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 6-(Phenyliminomethyl)pyridine-2-carbothioamide?
The CAS number of 6-(Phenyliminomethyl)pyridine-2-carbothioamide is 78797-13-4.
What is the molecular formula of 6-(Phenyliminomethyl)pyridine-2-carbothioamide?
The molecular formula of 6-(Phenyliminomethyl)pyridine-2-carbothioamide is C13H11N3S.
What is the molecular weight of 6-(Phenyliminomethyl)pyridine-2-carbothioamide?
The molecular weight of 6-(Phenyliminomethyl)pyridine-2-carbothioamide is 241.07 g/mol.
Where can I buy 6-(Phenyliminomethyl)pyridine-2-carbothioamide?
You can request a quote for 6-(Phenyliminomethyl)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 6-(Phenyliminomethyl)pyridine-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 6-(Phenyliminomethyl)pyridine-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.