2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide
TL;DR: 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide (CAS 25372-99-0) is a chemical compound with molecular formula C5H8N4OS and molecular weight 172.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-cyanoacetyl)amino]-3-methylthiourea
Also Known As: 1-[(2-cyanoacetyl)amino]-3-methylthiourea, 1-[(2-cyanoacetyl)amino]-3-methyl-thiourea, 2-cyano-N-[(methylcarbamothioyl)amino]acetamide, 2-(2-cyanoacetyl)-N-methylhydrazinecarbothioamide, 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide
| Molecular Formula | C5H8N4OS |
|---|---|
| Molecular Weight | 172.04 g/mol |
| LogP | -0.97482 |
| Topological Polar Surface Area | 76.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.04189 |
| Heavy Atoms | 11 |
| Complexity | 197.14932 |
Chemical Identifiers
| CAS Number | 25372-99-0 |
|---|---|
| SMILES | CNC(=S)NNC(=O)CC#N |
Product Overview
2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide (CAS 25372-99-0), with molecular formula C5H8N4OS and molecular weight 172.04 g/mol. IUPAC: 1-[(2-cyanoacetyl)amino]-3-methylthiourea.
Chemical Property Profile of 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide
Property Insights of 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide
The XLogP value of -0.97482 indicates that 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide. Following Lipinski's Rule of Five, 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide has 3 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-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide?
The CAS number of 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide is 25372-99-0.
What is the molecular formula of 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide?
The molecular formula of 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide is C5H8N4OS.
What is the molecular weight of 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide?
The molecular weight of 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide is 172.04 g/mol.
Where can I buy 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide?
You can request a quote for 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Cyanoacetyl)-N-methylhydrazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.