5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)
TL;DR: 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) (CAS 89752-56-7) is a chemical compound with molecular formula C18H15N3O5S2 and molecular weight 417.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-[(4-nitroanilino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino), 5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-[(4-nitroanilino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C18H15N3O5S2 |
|---|---|
| Molecular Weight | 417.05 g/mol |
| LogP | 3.5798 |
| Topological Polar Surface Area | 104.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.04532 |
| Heavy Atoms | 28 |
| Complexity | 975.6864 |
Chemical Identifiers
| CAS Number | 89752-56-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CNC3=CC=C(C=C3)[N+](=O)[O-])O |
Product Overview
5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) (CAS 89752-56-7), with molecular formula C18H15N3O5S2 and molecular weight 417.05 g/mol. IUPAC: 5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-[(4-nitroanilino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)
Property Insights of 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)
The XLogP value of 3.5798 indicates that 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino). Following Lipinski's Rule of Five, 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) has 2 hydrogen bond donor(s) and 8 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 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)?
The CAS number of 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) is 89752-56-7.
What is the molecular formula of 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)?
The molecular formula of 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) is C18H15N3O5S2.
What is the molecular weight of 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)?
The molecular weight of 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) is 417.05 g/mol.
Where can I buy 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)?
You can request a quote for 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino)?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-hydroxy-3-methoxybenzylidene)-3-(((4-nitrophenyl)amino) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.