N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide
TL;DR: N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide (CAS 113399-72-7) is a chemical compound with molecular formula C13H13N5OS and molecular weight 287.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-3-(pyrazine-2-carbonylamino)thiourea
Also Known As: 1-(4-methylphenyl)-3-(pyrazine-2-carbonylamino)thiourea, 2-(pyrazine-2-carbonyl)-N-(p-tolyl)hydrazinecarbothioamide, N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide, N-({[(4-methylphenyl)amino]thioxomethyl}amino)pyrazin-2-ylcarboxamide
| Molecular Formula | C13H13N5OS |
|---|---|
| Molecular Weight | 287.08 g/mol |
| LogP | 1.41642 |
| Topological Polar Surface Area | 78.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.08408 |
| Heavy Atoms | 20 |
| Complexity | 599.9184 |
Chemical Identifiers
| CAS Number | 113399-72-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NNC(=O)C2=NC=CN=C2 |
Product Overview
N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide (CAS 113399-72-7), with molecular formula C13H13N5OS and molecular weight 287.08 g/mol. IUPAC: 1-(4-methylphenyl)-3-(pyrazine-2-carbonylamino)thiourea.
Chemical Property Profile of N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide
Property Insights of N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide
The XLogP value of 1.41642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide. The TPSA of 78.94 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide has 3 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 N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide?
The CAS number of N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide is 113399-72-7.
What is the molecular formula of N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide?
The molecular formula of N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide is C13H13N5OS.
What is the molecular weight of N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide?
The molecular weight of N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide is 287.08 g/mol.
Where can I buy N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide?
You can request a quote for N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methylphenyl)-2-(pyrazin-2-ylcarbonyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.