methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate
TL;DR: methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate (CAS 75565-11-6) is a chemical compound with molecular formula C8H14N4S and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-cyano-4-methylpiperazine-1-carboximidothioate
Also Known As: methyl N-cyano-4-methylpiperazine-1-carboximidothioate, methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate, 7C-042, [(4-methylpiperazin-1-yl)-methylsulfanyl-methylidene]cyanamide, (Z)-cyano[(4-methylpiperazin-1-yl)(methylsulfanyl)methylidene]amine
| Molecular Formula | C8H14N4S |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 0.43388 |
| Topological Polar Surface Area | 42.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.09392 |
| Heavy Atoms | 13 |
| Complexity | 224.78876 |
Chemical Identifiers
| CAS Number | 75565-11-6 |
|---|---|
| SMILES | CN1CCN(CC1)C(=NC#N)SC |
Product Overview
methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate (CAS 75565-11-6), with molecular formula C8H14N4S and molecular weight 198.09 g/mol. IUPAC: methyl N-cyano-4-methylpiperazine-1-carboximidothioate.
Chemical Property Profile of methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate
Property Insights of methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate
The XLogP value of 0.43388 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate. With a topological polar surface area (TPSA) of 42.63 Ų, methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate has 0 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 methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate?
The CAS number of methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate is 75565-11-6.
What is the molecular formula of methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate?
The molecular formula of methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate is C8H14N4S.
What is the molecular weight of methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate?
The molecular weight of methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate is 198.09 g/mol.
Where can I buy methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate?
You can request a quote for methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-cyano-4-methyltetrahydro-1(2H)-pyrazinecarbimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.