Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate
TL;DR: Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate (CAS 101651-67-6) is a chemical compound with molecular formula C21H25ClN2O5S and molecular weight 452.11728 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[4-(4-chlorophenyl)sulfanyl-N-methylanilino]-2-oxoethyl]-diethylazanium;2-hydroxy-2-oxoacetate
Also Known As: ACETANILIDE, 4'-(p-CHLOROPHENYLTHIO)-2-(DIETHYLAMINO)-N-METHYL-, OXALATE, 4'-(p-Chlorophenylthio)-2-(diethylamino)-N-methyl-acetanilide oxalate, N-((Diethylamino)acetyl)-N-methyl-2-((4-chlorophenyl)thio)phenylamine oxalate, [2-[4-(4-chlorophenyl)sulfanyl-N-methylanilino]-2-oxoethyl]-diethylazanium; 2-hydroxy-2-oxoacetate, ACETANILIDE,4'-(p-CHLOROPHENYLTHIO)-2-(DIETHYLAMINO)-N-METHYL-,OXALATE
Technical Specifications
| Molecular Formula | C21H25ClN2O5S |
| Molecular Weight | 452.11728 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 127.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.11728 Da |
| Heavy Atoms | 30 |
| Complexity | 454.0 |
| SMILES | CC[NH+](CC)CC(=O)N(C)C1=CC=C(C=C1)SC2=CC=C(C=C2)Cl.C(=O)(C(=O)[O-])O |
| InChIKey | CSBQUHDTOUATGO-UHFFFAOYSA-N |
Chemical Property Profile of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate
Property Insights of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate. Following Lipinski's Rule of Five, Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate?
The CAS number of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate is 101651-67-6.
What is the molecular formula of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate?
The molecular formula of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate is C21H25ClN2O5S.
What is the molecular weight of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate?
The molecular weight of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate is 452.11728 g/mol.
Where can I buy Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate?
You can request a quote for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate?
Yes, CoreyChem provides custom synthesis services for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-N-methyl-, oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.