5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone
TL;DR: 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone (CAS 429652-05-1) is a chemical compound with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2-ethoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
Also Known As: 5-(2-ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone, AB00111760-01, AN-989/40746970, (5Z)-5-(2-ethoxybenzylidene)-3-methyl-2-thioxoimidazolidin-4-one, (5Z)-5-[(2-ethoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
| Molecular Formula | C13H14N2O2S |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 1.7727 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.0776 |
| Heavy Atoms | 18 |
| Complexity | 525.4775 |
Chemical Identifiers
| CAS Number | 429652-05-1 |
|---|---|
| SMILES | CCOC1=CC=CC=C1/C=C\2/C(=O)N(C(=S)N2)C |
Product Overview
5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone (CAS 429652-05-1), with molecular formula C13H14N2O2S and molecular weight 262.08 g/mol. IUPAC: (5Z)-5-[(2-ethoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone
Property Insights of 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone
The XLogP value of 1.7727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone. With a topological polar surface area (TPSA) of 41.57 Ų, 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone has 1 hydrogen bond donor(s) and 3 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-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
The CAS number of 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is 429652-05-1.
What is the molecular formula of 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
The molecular formula of 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is C13H14N2O2S.
What is the molecular weight of 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
The molecular weight of 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is 262.08 g/mol.
Where can I buy 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
You can request a quote for 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Ethoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.