6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide
TL;DR: 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide (CAS 78797-12-3) is a chemical compound with molecular formula C13H12N4S and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide
Also Known As: 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide, 6-[(E)-(2-Phenylhydrazinylidene)methyl]pyridine-2-carbothioamide
| Molecular Formula | C13H12N4S |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 2.1618 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.07828 |
| Heavy Atoms | 18 |
| Complexity | 566.21375 |
Chemical Identifiers
| CAS Number | 78797-12-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N/N=C/C2=NC(=CC=C2)C(=S)N |
Product Overview
6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide (CAS 78797-12-3), with molecular formula C13H12N4S and molecular weight 256.08 g/mol. IUPAC: 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide.
Chemical Property Profile of 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide
Property Insights of 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide
The XLogP value of 2.1618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide. Following Lipinski's Rule of Five, 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide has 2 hydrogen bond donor(s) and 4 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-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide?
The CAS number of 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide is 78797-12-3.
What is the molecular formula of 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide?
The molecular formula of 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide is C13H12N4S.
What is the molecular weight of 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide?
The molecular weight of 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide is 256.08 g/mol.
Where can I buy 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide?
You can request a quote for 6-[(E)-(phenylhydrazinylidene)methyl]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-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 6-[(E)-(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.