Methyldithiocarbazate
TL;DR: Methyldithiocarbazate (CAS 5397-03-5) is a chemical compound with molecular formula C2H6N2S2 and molecular weight 122.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-aminocarbamodithioate
Also Known As: Methyl hydrazinecarbodithioate, Methyldithiocarbazate, Methyl dithiocarbazate, S-Methyl dithiocarbazate, methyl N-aminocarbamodithioate
| Molecular Formula | C2H6N2S2 |
|---|---|
| Molecular Weight | 122.00 g/mol |
| LogP | 0.0976 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 121.99724 |
| Heavy Atoms | 6 |
| Complexity | 47.509773 |
Chemical Identifiers
| CAS Number | 5397-03-5 |
|---|---|
| SMILES | CSC(=S)NN |
Product Overview
Methyldithiocarbazate (CAS 5397-03-5), with molecular formula C2H6N2S2 and molecular weight 122.00 g/mol. IUPAC: methyl N-aminocarbamodithioate.
Chemical Property Profile of Methyldithiocarbazate
Property Insights of Methyldithiocarbazate
The XLogP value of 0.0976 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyldithiocarbazate. With a topological polar surface area (TPSA) of 38.05 Ų, Methyldithiocarbazate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyldithiocarbazate has 2 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 Methyldithiocarbazate?
The CAS number of Methyldithiocarbazate is 5397-03-5.
What is the molecular formula of Methyldithiocarbazate?
The molecular formula of Methyldithiocarbazate is C2H6N2S2.
What is the molecular weight of Methyldithiocarbazate?
The molecular weight of Methyldithiocarbazate is 122.00 g/mol.
Where can I buy Methyldithiocarbazate?
You can request a quote for Methyldithiocarbazate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyldithiocarbazate?
Yes, KEHONG BIO provides custom synthesis services for Methyldithiocarbazate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.