1-Methyl-5,5-diphenyl-4-thiohydantoin
TL;DR: 1-Methyl-5,5-diphenyl-4-thiohydantoin (CAS 6825-98-5) is a chemical compound with molecular formula C16H14N2OS and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5,5-diphenyl-4-sulfanylideneimidazolidin-2-one
Also Known As: 1-Methyl-5,5-diphenyl-4-thiohydantoin, 1-methyl-5,5-diphenyl-4-thioxoimidazolidin-2-one, 1-Methyl-5,5-diphenyl-4-thioxo-2-imidazolidinone #, 1-methyl-5,5-diphenyl-4-sulfanylideneimidazolidin-2-one
| Molecular Formula | C16H14N2OS |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 2.9126 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.08267 |
| Heavy Atoms | 20 |
| Complexity | 615.1918 |
Chemical Identifiers
| CAS Number | 6825-98-5 |
|---|---|
| SMILES | CN1C(=O)NC(=S)C1(C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
1-Methyl-5,5-diphenyl-4-thiohydantoin (CAS 6825-98-5), with molecular formula C16H14N2OS and molecular weight 282.08 g/mol. IUPAC: 1-methyl-5,5-diphenyl-4-sulfanylideneimidazolidin-2-one.
Chemical Property Profile of 1-Methyl-5,5-diphenyl-4-thiohydantoin
Property Insights of 1-Methyl-5,5-diphenyl-4-thiohydantoin
The XLogP value of 2.9126 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-5,5-diphenyl-4-thiohydantoin. With a topological polar surface area (TPSA) of 32.34 Ų, 1-Methyl-5,5-diphenyl-4-thiohydantoin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-5,5-diphenyl-4-thiohydantoin 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 1-Methyl-5,5-diphenyl-4-thiohydantoin?
The CAS number of 1-Methyl-5,5-diphenyl-4-thiohydantoin is 6825-98-5.
What is the molecular formula of 1-Methyl-5,5-diphenyl-4-thiohydantoin?
The molecular formula of 1-Methyl-5,5-diphenyl-4-thiohydantoin is C16H14N2OS.
What is the molecular weight of 1-Methyl-5,5-diphenyl-4-thiohydantoin?
The molecular weight of 1-Methyl-5,5-diphenyl-4-thiohydantoin is 282.08 g/mol.
Where can I buy 1-Methyl-5,5-diphenyl-4-thiohydantoin?
You can request a quote for 1-Methyl-5,5-diphenyl-4-thiohydantoin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-5,5-diphenyl-4-thiohydantoin?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-5,5-diphenyl-4-thiohydantoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.