5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
TL;DR: 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one (CAS 51009-66-6) is a chemical compound with molecular formula C11H10N2OS and molecular weight 218.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
Also Known As: NCI60_030273, 5-[(4-Methylphenyl)methylene]-2-thioxo-4-imidazolidinone, 5-(4-methyl-benzylidene)-2-thioxo-imidazolidin-4-one, 5-[(4-methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
| Molecular Formula | C11H10N2OS |
|---|---|
| Molecular Weight | 218.05 g/mol |
| LogP | 1.34022 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.05139 |
| Heavy Atoms | 15 |
| Complexity | 448.16064 |
Chemical Identifiers
| CAS Number | 51009-66-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C=C2C(=O)NC(=S)N2 |
Product Overview
5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one (CAS 51009-66-6), with molecular formula C11H10N2OS and molecular weight 218.05 g/mol. IUPAC: 5-[(4-methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
Property Insights of 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
The XLogP value of 1.34022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one. With a topological polar surface area (TPSA) of 41.13 Ų, 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one has 2 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 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one?
The CAS number of 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one is 51009-66-6.
What is the molecular formula of 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one?
The molecular formula of 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one is C11H10N2OS.
What is the molecular weight of 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one?
The molecular weight of 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one is 218.05 g/mol.
Where can I buy 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one?
You can request a quote for 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.