4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine
TL;DR: 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine (CAS 64958-41-4) is a chemical compound with molecular formula C10H7ClN2OS and molecular weight 238.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2-chlorophenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
Also Known As: J1.088.163C, J1.411.390H, 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine, 5-(2-Chlorobenzylidene)-2-thioxo-4-imidazolidinone, 2-Thioxo-4-(2-chlorobenzylidene)imidazolidine-5-one
| Molecular Formula | C10H7ClN2OS |
|---|---|
| Molecular Weight | 238.00 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.99677 |
| Heavy Atoms | 15 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 64958-41-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C\2/C(=O)NC(=S)N2)Cl |
| InChIKey | HSAIZKCQBWCNNP-YVMONPNESA-N |
Product Overview
4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine (CAS 64958-41-4), with molecular formula C10H7ClN2OS and molecular weight 238.00 g/mol. IUPAC: (5Z)-5-[(2-chlorophenyl)methylidene]-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine
Property Insights of 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine. Following Lipinski's Rule of Five, 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine 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 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine?
The CAS number of 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine is 64958-41-4.
What is the molecular formula of 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine?
The molecular formula of 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine is C10H7ClN2OS.
What is the molecular weight of 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine?
The molecular weight of 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine is 238.00 g/mol.
Where can I buy 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine?
You can request a quote for 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(O-Chlorobenzylidene)-5-oxo-2-thioxoimidazolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.