RefChem:315076
TL;DR: RefChem:315076 (CAS 128433-42-1) is a chemical compound with molecular formula C20H20BrN3O3S and molecular weight 461.0409 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-benzoyl-4-methoxyphenyl)-2-(1H-imidazol-2-ylsulfanyl)-N-methylacetamide;hydrobromide
Also Known As: Acetamide, N-(2-benzoyl-4-methoxyphenyl)-2-(1H-imidazol-2-ylthio)-N-methyl-, monohydrobromide, N-Methyl-2'-benzoyl-4'-methoxy-2-((2-imidazolyl)thio)acetanilide hydrobromide, N-(2-Benzoyl-4-methoxyphenyl)-2-(1H-imidazol-2-ylthio)-N-methylacetamide monohydrobromide, N-(2-benzoyl-4-methoxyphenyl)-2-(1H-imidazol-2-ylsulfanyl)-N-methylacetamide hydrobromide, N-(2-Benzoyl-4-methoxyphenyl)-2-[(1H-imidazol-2-yl)sulfanyl]-N-methylacetamide--hydrogen bromide (1/1)
Technical Specifications
| Molecular Formula | C20H20BrN3O3S |
| Molecular Weight | 461.0409 g/mol |
| XLogP | 3.9823 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.0409 Da |
| Heavy Atoms | 28 |
| Complexity | 513.0 |
| SMILES | CN(C1=C(C=C(C=C1)OC)C(=O)C2=CC=CC=C2)C(=O)CSC3=NC=CN3.Br |
| InChIKey | QKNHVWFZAOPYJG-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:315076
Property Insights of RefChem:315076
The XLogP value of 3.9823 indicates that RefChem:315076 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:315076. Following Lipinski's Rule of Five, RefChem:315076 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:315076?
The CAS number of RefChem:315076 is 128433-42-1.
What is the molecular formula of RefChem:315076?
The molecular formula of RefChem:315076 is C20H20BrN3O3S.
What is the molecular weight of RefChem:315076?
The molecular weight of RefChem:315076 is 461.0409 g/mol.
Where can I buy RefChem:315076?
You can request a quote for RefChem:315076 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:315076?
Yes, CoreyChem provides custom synthesis services for RefChem:315076 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.