Methylthiohydantoin
TL;DR: Methylthiohydantoin (CAS 694-68-8) is a chemical compound with molecular formula C4H6N2OS and molecular weight 130.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-sulfanylideneimidazolidin-4-one
Also Known As: 3-methyl-2-thioxoimidazolidin-4-one, Methylthiohydantoin, MTH-GLYCINE, 3-methyl-2-sulfanylideneimidazolidin-4-one, 3-methyl thiohydantoin
| Molecular Formula | C4H6N2OS |
|---|---|
| Molecular Weight | 130.02 g/mol |
| LogP | -0.6671 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.02008 |
| Heavy Atoms | 8 |
| Complexity | 128.97374 |
Chemical Identifiers
| CAS Number | 694-68-8 |
|---|---|
| SMILES | CN1C(=O)CNC1=S |
Product Overview
Methylthiohydantoin (CAS 694-68-8), with molecular formula C4H6N2OS and molecular weight 130.02 g/mol. IUPAC: 3-methyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of Methylthiohydantoin
Property Insights of Methylthiohydantoin
The XLogP value of -0.6671 indicates that Methylthiohydantoin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.34 Ų, Methylthiohydantoin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methylthiohydantoin has 1 hydrogen bond donor(s) and 2 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 Methylthiohydantoin?
The CAS number of Methylthiohydantoin is 694-68-8.
What is the molecular formula of Methylthiohydantoin?
The molecular formula of Methylthiohydantoin is C4H6N2OS.
What is the molecular weight of Methylthiohydantoin?
The molecular weight of Methylthiohydantoin is 130.02 g/mol.
Where can I buy Methylthiohydantoin?
You can request a quote for Methylthiohydantoin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylthiohydantoin?
Yes, KEHONG BIO provides custom synthesis services for Methylthiohydantoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.