TL;DR: RefChem:315375 (CAS 128433-27-2) is a chemical compound with molecular formula C19H16Cl3N3O2S and molecular weight 455.00287 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-2-(1H-imidazol-2-ylsulfanyl)-N-methylacetamide;hydrochloride
Also Known As: Acetamide, N-(4-chloro-2-(2-chlorobenzoyl)phenyl)-2-(1H-imidazol-2-ylthio)-N-methyl-, monohydrochloride, N-Methyl-2-orthochlorobenzoyl-4'-chloro-2-((2-imidazolyl)thio)acetanilide hydrochloride, N-methyl 2'-orthochlorobenzoyl-4'-chloro 2-[(2-imidazolyl)thio]acetanilide hydrochloride, N-[4-chloro-2-(2-chlorobenzoyl)phenyl]-2-(1H-imidazol-2-ylsulfanyl)-N-methylacetamide hydrochloride, N-[4-Chloro-2-(2-chlorobenzoyl)phenyl]-2-[(1H-imidazol-2-yl)sulfanyl]-N-methylacetamide--hydrogen chloride (1/1)
| Molecular Formula | C19H16Cl3N3O2S |
| Molecular Weight | 455.00287 g/mol |
| XLogP | 5.1244 |
| Topological Polar Surface Area (TPSA) | 91.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.00287 Da |
| Heavy Atoms | 28 |
| Complexity | 539.0 |
| SMILES | CN(C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2Cl)C(=O)CSC3=NC=CN3.Cl |
| InChIKey | UPYOXEDEHRFKKV-UHFFFAOYSA-N |
The XLogP value of 5.1244 indicates that RefChem:315375 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:315375. Following Lipinski's Rule of Five, RefChem:315375 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:315375 is 128433-27-2.
The molecular formula of RefChem:315375 is C19H16Cl3N3O2S.
The molecular weight of RefChem:315375 is 455.00287 g/mol.
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