5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-
TL;DR: 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- (CAS 681458-79-7) is a chemical compound with molecular formula C17H13N3O4S2 and molecular weight 387.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-hydroxyphenyl)methylidene]-3-[(4-nitroanilino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-, 5-[(2-hydroxyphenyl)methylidene]-3-[(4-nitroanilino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C17H13N3O4S2 |
|---|---|
| Molecular Weight | 387.03 g/mol |
| LogP | 3.5712 |
| Topological Polar Surface Area | 95.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.03476 |
| Heavy Atoms | 26 |
| Complexity | 912.47894 |
Chemical Identifiers
| CAS Number | 681458-79-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CNC3=CC=C(C=C3)[N+](=O)[O-])O |
Product Overview
5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- (CAS 681458-79-7), with molecular formula C17H13N3O4S2 and molecular weight 387.03 g/mol. IUPAC: 5-[(2-hydroxyphenyl)methylidene]-3-[(4-nitroanilino)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-
Property Insights of 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-
The XLogP value of 3.5712 indicates that 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-. Following Lipinski's Rule of Five, 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- has 2 hydrogen bond donor(s) and 7 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-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-?
The CAS number of 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- is 681458-79-7.
What is the molecular formula of 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-?
The molecular formula of 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- is C17H13N3O4S2.
What is the molecular weight of 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-?
The molecular weight of 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- is 387.03 g/mol.
Where can I buy 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-?
You can request a quote for 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2-?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-hydroxybenzylidene)-3-(((4-nitrophenyl)amino)methyl)-2- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.