BAS 00319542
TL;DR: BAS 00319542 (CAS 691881-74-0) is a chemical compound with molecular formula C15H10N2O4S2 and molecular weight 346.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-methyl-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00319542, AB00074389-01, (5e)-3-methyl-5-{[5-(3-nitrophenyl)-2-furyl]methylene}-2-thioxo-1,3-thiazolidin-4-one, (E)-3-methyl-5-((5-(3-nitrophenyl)furan-2-yl)methylene)-2-thioxothiazolidin-4-one, 3-Methyl-5-[5-(3-nitro-phenyl)-furan-2-ylmethylene]-2-thioxo-thiazolidin-4-one
| Molecular Formula | C15H10N2O4S2 |
|---|---|
| Molecular Weight | 346.01 g/mol |
| LogP | 3.6858 |
| Topological Polar Surface Area | 76.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.0082 |
| Heavy Atoms | 23 |
| Complexity | 856.6667 |
Chemical Identifiers
| CAS Number | 691881-74-0 |
|---|---|
| SMILES | CN1C(=O)/C(=C\C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])/SC1=S |
Product Overview
BAS 00319542 (CAS 691881-74-0), with molecular formula C15H10N2O4S2 and molecular weight 346.01 g/mol. IUPAC: (5E)-3-methyl-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00319542
Property Insights of BAS 00319542
The XLogP value of 3.6858 indicates that BAS 00319542 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 BAS 00319542. Following Lipinski's Rule of Five, BAS 00319542 has 0 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 BAS 00319542?
The CAS number of BAS 00319542 is 691881-74-0.
What is the molecular formula of BAS 00319542?
The molecular formula of BAS 00319542 is C15H10N2O4S2.
What is the molecular weight of BAS 00319542?
The molecular weight of BAS 00319542 is 346.01 g/mol.
Where can I buy BAS 00319542?
You can request a quote for BAS 00319542 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00319542?
Yes, KEHONG BIO provides custom synthesis services for BAS 00319542 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.