Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate
TL;DR: Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate (CAS 77711-61-6) is a chemical compound with molecular formula C20H23ClN2O5S and molecular weight 438.10162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[4-(4-chlorophenyl)sulfanylanilino]-2-oxoethyl]-diethylazanium;2-hydroxy-2-oxoacetate
Also Known As: 4'-(p-Chlorophenylthio)-2-(diethylamino)-acetanilide oxalate, N-((Diethylamino)acetyl)-4-((4-chlorophenyl)thio)phenylamine oxalate, ACETANILIDE, 4'-(p-CHLOROPHENYLTHIO)-2-(DIETHYLAMINO)-, OXALATE, N-<(diethylamino)acetyl>-4-<(4-chlorophenyl)thio>phenylamine, [2-[4-(4-chlorophenyl)sulfanylanilino]-2-oxoethyl]-diethylazanium; 2-hydroxy-2-oxoacetate
Technical Specifications
| Molecular Formula | C20H23ClN2O5S |
| Molecular Weight | 438.10162 g/mol |
| XLogP | 1.18 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 438.10162 Da |
| Heavy Atoms | 29 |
| Complexity | 427.0 |
| SMILES | CC[NH+](CC)CC(=O)NC1=CC=C(C=C1)SC2=CC=C(C=C2)Cl.C(=O)(C(=O)[O-])O |
| InChIKey | QGPBPFFATOOKIT-UHFFFAOYSA-N |
Chemical Property Profile of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate
Property Insights of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate
The XLogP value of 1.18 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate. Following Lipinski's Rule of Five, Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate has 3 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)-, oxalate?
The CAS number of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate is 77711-61-6.
What is the molecular formula of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate?
The molecular formula of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate is C20H23ClN2O5S.
What is the molecular weight of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate?
The molecular weight of Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate is 438.10162 g/mol.
Where can I buy Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate?
You can request a quote for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, 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)-, oxalate?
Yes, CoreyChem provides custom synthesis services for Acetanilide, 4'-(p-chlorophenylthio)-2-(diethylamino)-, oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.