Tetrachloro-4-nitrophenol
TL;DR: Tetrachloro-4-nitrophenol (CAS 4824-74-2) is a chemical compound with molecular formula C21H17NO4S and molecular weight 379.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-ylmethyl)-4-[hydroxy-(4-methylphenyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: Tetrachloro-4-nitrophenol, 1-(furan-2-ylmethyl)-4-[hydroxy-(4-methylphenyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione, 1-(2-furylmethyl)-4-[hydroxy-(4-methylphenyl)methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione, 1-[(Furan-2-yl)methyl]-4-[hydroxy(4-methylphenyl)methylidene]-5-(thiophen-2-yl)pyrrolidine-2,3-dione
| Molecular Formula | C21H17NO4S |
|---|---|
| Molecular Weight | 379.09 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.08783 |
| Heavy Atoms | 27 |
| Complexity | 626.0 |
Chemical Identifiers
| CAS Number | 4824-74-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CC=CO3)C4=CC=CS4)O |
| InChIKey | XTRHMDDEVNOSMJ-UHFFFAOYSA-N |
Product Overview
Tetrachloro-4-nitrophenol (CAS 4824-74-2), with molecular formula C21H17NO4S and molecular weight 379.09 g/mol. IUPAC: 1-(furan-2-ylmethyl)-4-[hydroxy-(4-methylphenyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of Tetrachloro-4-nitrophenol
Property Insights of Tetrachloro-4-nitrophenol
The XLogP value of 3.6 indicates that Tetrachloro-4-nitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetrachloro-4-nitrophenol. Following Lipinski's Rule of Five, Tetrachloro-4-nitrophenol has 1 hydrogen bond donor(s) and 5 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 Tetrachloro-4-nitrophenol?
The CAS number of Tetrachloro-4-nitrophenol is 4824-74-2.
What is the molecular formula of Tetrachloro-4-nitrophenol?
The molecular formula of Tetrachloro-4-nitrophenol is C21H17NO4S.
What is the molecular weight of Tetrachloro-4-nitrophenol?
The molecular weight of Tetrachloro-4-nitrophenol is 379.09 g/mol.
Where can I buy Tetrachloro-4-nitrophenol?
You can request a quote for Tetrachloro-4-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrachloro-4-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for Tetrachloro-4-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.