RefChem:404274
TL;DR: RefChem:404274 (CAS 312935-62-9) is a chemical compound with molecular formula C21H14N2O4S2 and molecular weight 422.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3-methylphenyl)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-(3-methylphenyl)-5-{[5-(2-nitrophenyl)-2-furyl]methylene}-2-thioxo-1,3-thiazolidin-4-one, 5-((5-(2-Nitrophenyl)furan-2-yl)methylene)-2-thioxo-3-(m-tolyl)thiazolidin-4-one, (5E)-3-(3-methylphenyl)-5-{[5-(2-nitrophenyl)-2-furyl]methylene}-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-(3-methylphenyl)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-3-(3-Methylphenyl)-5-((5-(2-nitrophenyl)-2-furyl)methylene)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C21H14N2O4S2 |
|---|---|
| Molecular Weight | 422.04 g/mol |
| LogP | 5.56902 |
| Topological Polar Surface Area | 76.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.0395 |
| Heavy Atoms | 29 |
| Complexity | 1182.6841 |
Chemical Identifiers
| CAS Number | 312935-62-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-])/SC2=S |
Product Overview
RefChem:404274 (CAS 312935-62-9), with molecular formula C21H14N2O4S2 and molecular weight 422.04 g/mol. IUPAC: (5Z)-3-(3-methylphenyl)-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:404274
Property Insights of RefChem:404274
The XLogP value of 5.56902 indicates that RefChem:404274 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.59 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:404274. Following Lipinski's Rule of Five, RefChem:404274 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:404274?
The CAS number of RefChem:404274 is 312935-62-9.
What is the molecular formula of RefChem:404274?
The molecular formula of RefChem:404274 is C21H14N2O4S2.
What is the molecular weight of RefChem:404274?
The molecular weight of RefChem:404274 is 422.04 g/mol.
Where can I buy RefChem:404274?
You can request a quote for RefChem:404274 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404274?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404274 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.