![2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide structure](/static/products/4591/459181-94-3.webp)
2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide
TL;DR: 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide (CAS 459181-94-3) is a chemical compound with molecular formula C15H10F3N3O5S and molecular weight 401.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dinitrophenyl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: VU0509266-1, AB00682630-01, F3103-0021, 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide, 2-[(2,4-DINITROPHENYL)SULFANYL]-N-[3-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
| Molecular Formula | C15H10F3N3O5S |
|---|---|
| Molecular Weight | 401.03 g/mol |
| LogP | 4.2526 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.02933 |
| Heavy Atoms | 27 |
| Complexity | 904.50653 |
Chemical Identifiers
| CAS Number | 459181-94-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F |
Product Overview
2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide (CAS 459181-94-3), with molecular formula C15H10F3N3O5S and molecular weight 401.03 g/mol. IUPAC: 2-(2,4-dinitrophenyl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide
Property Insights of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide
The XLogP value of 4.2526 indicates that 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide. Following Lipinski's Rule of Five, 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide?
The CAS number of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide is 459181-94-3.
What is the molecular formula of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide?
The molecular formula of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide is C15H10F3N3O5S.
What is the molecular weight of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide?
The molecular weight of 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide is 401.03 g/mol.
Where can I buy 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide?
You can request a quote for 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-dinitrophenylthio)-N-[3-(trifluoromethyl)phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.