2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride
TL;DR: 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride (CAS 128433-25-0) is a chemical compound with molecular formula C18H15Cl2N3O2S and molecular weight 407.0262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-benzoyl-4-chlorophenyl)-2-(1H-imidazol-2-ylsulfanyl)acetamide;hydrochloride
Also Known As: 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride, Acetamide, N-(2-benzoyl-4-chlorophenyl)-2-(1H-imidazol-2-ylthio)-, monohydrochloride, N-(2-Benzoyl-4-chlorophenyl)-2-(1H-imidazol-2-ylthio)acetamide monohydrochloride, ACETAMIDE,N-(2-BENZOYL-4-CHLOROPHENYL)-2-(1H-IMIDAZOL-2-YLTHIO)- HCL, N-(2-benzoyl-4-chloro-phenyl)-2-(1H-imidazol-2-ylsulfanyl)acetamide hy drochloride
Technical Specifications
| Molecular Formula | C18H15Cl2N3O2S |
| Molecular Weight | 407.0262 g/mol |
| XLogP | 4.4467 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.0262 Da |
| Heavy Atoms | 26 |
| Complexity | 473.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC(=O)CSC3=NC=CN3.Cl |
| InChIKey | RKTIAUHSSIPIDA-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride
Property Insights of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride
The XLogP value of 4.4467 indicates that 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride. Following Lipinski's Rule of Five, 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride?
The CAS number of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride is 128433-25-0.
What is the molecular formula of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride?
The molecular formula of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride is C18H15Cl2N3O2S.
What is the molecular weight of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride?
The molecular weight of 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride is 407.0262 g/mol.
Where can I buy 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride?
You can request a quote for 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride?
Yes, CoreyChem provides custom synthesis services for 2-(2-Imidazolylthio)-2'-benzoyl-4'-chloroacetanilide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.