3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one
TL;DR: 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one (CAS 80944-82-7) is a chemical compound with molecular formula C10H10N2OS and molecular weight 206.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-phenyl-2-sulfanylideneimidazolidin-4-one
Also Known As: 3-methyl-1-phenyl-2-thioxoimidazolidin-4-one, 3-methyl-1-phenyl-2-sulfanylideneimidazolidin-4-one, 4-Imidazolidinone, 3-methyl-1-phenyl-2-thioxo-, 3-methyl-1-phenyl-2-thioxo-imidazolidin-4-one, 3-methyl-1-phenyl-2-thioxo-1,3-diazolidin-4-one
| Molecular Formula | C10H10N2OS |
|---|---|
| Molecular Weight | 206.05 g/mol |
| LogP | 1.2499 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.05139 |
| Heavy Atoms | 14 |
| Complexity | 376.9682 |
Chemical Identifiers
| CAS Number | 80944-82-7 |
|---|---|
| SMILES | CN1C(=O)CN(C1=S)C2=CC=CC=C2 |
Product Overview
3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one (CAS 80944-82-7), with molecular formula C10H10N2OS and molecular weight 206.05 g/mol. IUPAC: 3-methyl-1-phenyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one
Property Insights of 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one
The XLogP value of 1.2499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one. With a topological polar surface area (TPSA) of 23.55 Ų, 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one has 0 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-1-phenyl-2-thioxoimidazolidin-4-one?
The CAS number of 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one is 80944-82-7.
What is the molecular formula of 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one?
The molecular formula of 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one is C10H10N2OS.
What is the molecular weight of 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one?
The molecular weight of 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one is 206.05 g/mol.
Where can I buy 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one?
You can request a quote for 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-phenyl-2-thioxoimidazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.