RefChem:1079092
TL;DR: RefChem:1079092 (CAS 89752-47-6) is a chemical compound with molecular formula C18H14N2O4S2 and molecular weight 386.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(5Z)-5-[(4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid
Also Known As: 4-(((5-((4-Hydroxyphenyl)methylene)-4-oxo-2-thioxo-3-thiazolidinyl)methyl)amino)benzoic acid, Benzoic acid, 4-(((5-((4-hydroxyphenyl)methylene)-4-oxo-2-thioxo-3-thiazolidinyl)methyl)amino)-, BENZOIC ACID, 4-(((5-((4-HYDROXYPHENYL)METHYLENE)-4-OXO-2-THIOXO-3-THIAZOLIDINYL, 4-[[(5Z)-5-[(4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid, RefChem:1079092
| Molecular Formula | C18H14N2O4S2 |
|---|---|
| Molecular Weight | 386.04 g/mol |
| LogP | 3.3612 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.0395 |
| Heavy Atoms | 26 |
| Complexity | 892.41205 |
Chemical Identifiers
| CAS Number | 89752-47-6 |
|---|---|
| SMILES | C1=CC(=CC=C1/C=C\2/C(=O)N(C(=S)S2)CNC3=CC=C(C=C3)C(=O)O)O |
Product Overview
RefChem:1079092 (CAS 89752-47-6), with molecular formula C18H14N2O4S2 and molecular weight 386.04 g/mol. IUPAC: 4-[[(5Z)-5-[(4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoic acid.
Chemical Property Profile of RefChem:1079092
Property Insights of RefChem:1079092
The XLogP value of 3.3612 indicates that RefChem:1079092 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1079092. Following Lipinski's Rule of Five, RefChem:1079092 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
Frequently Asked Questions
What is the CAS number of RefChem:1079092?
The CAS number of RefChem:1079092 is 89752-47-6.
What is the molecular formula of RefChem:1079092?
The molecular formula of RefChem:1079092 is C18H14N2O4S2.
What is the molecular weight of RefChem:1079092?
The molecular weight of RefChem:1079092 is 386.04 g/mol.
Where can I buy RefChem:1079092?
You can request a quote for RefChem:1079092 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1079092?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1079092 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.