5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone
TL;DR: 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone (CAS 1416577-04-2) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-5-[(4-methoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
Also Known As: AB00112252-01, 5-(4-methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone, AN-940/40805301, (5Z)-5-[(4-methoxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one, (5Z)-5-(4-methoxybenzylidene)-3-methyl-2-thioxoimidazolidin-4-one
Technical Specifications
| Molecular Formula | C12H12N2O2S |
| Molecular Weight | 248.06195 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 73.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.06195 Da |
| Heavy Atoms | 17 |
| Complexity | 360.0 |
| SMILES | CN1C(=O)/C(=C/C2=CC=C(C=C2)OC)/NC1=S |
| InChIKey | KCIKHUDZJCKDKB-YFHOEESVSA-N |
Chemical Property Profile of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone
Property Insights of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone. Following Lipinski's Rule of Five, 5-(4-Methoxybenzylidene)-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
What is the CAS number of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
The CAS number of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is 1416577-04-2.
What is the molecular formula of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
The molecular formula of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is C12H12N2O2S.
What is the molecular weight of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
The molecular weight of 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone is 248.06195 g/mol.
Where can I buy 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
You can request a quote for 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone?
Yes, CoreyChem provides custom synthesis services for 5-(4-Methoxybenzylidene)-3-methyl-2-thioxo-4-imidazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.