BAS 01261146
TL;DR: BAS 01261146 (CAS 300377-05-3) is a chemical compound with molecular formula C17H12N2O6S2 and molecular weight 404.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5E)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: BAS 01261146, F0165-0082, (E)-3-(5-((5-(4-nitrophenyl)furan-2-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid, 3-[(5E)-5-{[5-(4-NITROPHENYL)FURAN-2-YL]METHYLIDENE}-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]PROPANOIC ACID, 3-[(5E)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
| Molecular Formula | C17H12N2O6S2 |
|---|---|
| Molecular Weight | 404.01 g/mol |
| LogP | 3.5307 |
| Topological Polar Surface Area | 113.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.01367 |
| Heavy Atoms | 27 |
| Complexity | 964.05817 |
Chemical Identifiers
| CAS Number | 300377-05-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)/C=C/3\C(=O)N(C(=S)S3)CCC(=O)O)[N+](=O)[O-] |
Product Overview
BAS 01261146 (CAS 300377-05-3), with molecular formula C17H12N2O6S2 and molecular weight 404.01 g/mol. IUPAC: 3-[(5E)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid.
Chemical Property Profile of BAS 01261146
Property Insights of BAS 01261146
The XLogP value of 3.5307 indicates that BAS 01261146 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01261146. Following Lipinski's Rule of Five, BAS 01261146 has 1 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 BAS 01261146?
The CAS number of BAS 01261146 is 300377-05-3.
What is the molecular formula of BAS 01261146?
The molecular formula of BAS 01261146 is C17H12N2O6S2.
What is the molecular weight of BAS 01261146?
The molecular weight of BAS 01261146 is 404.01 g/mol.
Where can I buy BAS 01261146?
You can request a quote for BAS 01261146 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01261146?
Yes, KEHONG BIO provides custom synthesis services for BAS 01261146 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.