3-Methyl-5,5-diphenyl-4-thiohydantoin
TL;DR: 3-Methyl-5,5-diphenyl-4-thiohydantoin (CAS 3653-24-5) 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-4,4-diphenyl-5-sulfanylideneimidazolidin-2-one
Also Known As: 3-Methyl-5,5-diphenyl-4-thiohydantoin, 1-methyl-4,4-diphenyl-5-thioxoimidazolidin-2-one, 1-Methyl-4,4-diphenyl-5-thioxo-2-imidazolidinone #, 1-methyl-4,4-diphenyl-5-sulfanylideneimidazolidin-2-one
| Molecular Formula | C16H14N2OS |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.08267 |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 3653-24-5 |
|---|---|
| SMILES | CN1C(=S)C(NC1=O)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | BFCFAKALIVXXPM-UHFFFAOYSA-N |
Product Overview
3-Methyl-5,5-diphenyl-4-thiohydantoin (CAS 3653-24-5), with molecular formula C16H14N2OS and molecular weight 282.08 g/mol. IUPAC: 1-methyl-4,4-diphenyl-5-sulfanylideneimidazolidin-2-one.
Chemical Property Profile of 3-Methyl-5,5-diphenyl-4-thiohydantoin
Property Insights of 3-Methyl-5,5-diphenyl-4-thiohydantoin
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-5,5-diphenyl-4-thiohydantoin. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-5,5-diphenyl-4-thiohydantoin. Following Lipinski's Rule of Five, 3-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 3-Methyl-5,5-diphenyl-4-thiohydantoin?
The CAS number of 3-Methyl-5,5-diphenyl-4-thiohydantoin is 3653-24-5.
What is the molecular formula of 3-Methyl-5,5-diphenyl-4-thiohydantoin?
The molecular formula of 3-Methyl-5,5-diphenyl-4-thiohydantoin is C16H14N2OS.
What is the molecular weight of 3-Methyl-5,5-diphenyl-4-thiohydantoin?
The molecular weight of 3-Methyl-5,5-diphenyl-4-thiohydantoin is 282.08 g/mol.
Where can I buy 3-Methyl-5,5-diphenyl-4-thiohydantoin?
You can request a quote for 3-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 3-Methyl-5,5-diphenyl-4-thiohydantoin?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-5,5-diphenyl-4-thiohydantoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.