BAS 01151030
TL;DR: BAS 01151030 (CAS 851305-07-2) is a chemical compound with molecular formula C18H12F3NO4S2 and molecular weight 427.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5E)-4-oxo-2-sulfanylidene-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: BAS 01151030, 3-[(5E)-4-oxo-2-thioxo-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazolidin-3-yl]propanoic acid, (E)-3-(4-oxo-2-thioxo-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazolidin-3-yl)propanoic acid, 3-[(5E)-4-oxo-2-sulfanylidene-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazolidin-3-yl]propanoic acid, 3-[(5e)-4-oxo-2-thioxo-5-({5-[3-(trifluoromethyl)phenyl]-2-furyl}methylene)-1,3-thiazolidin-3-yl]propanoic acid
| Molecular Formula | C18H12F3NO4S2 |
|---|---|
| Molecular Weight | 427.02 g/mol |
| LogP | 4.6413 |
| Topological Polar Surface Area | 70.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.016 |
| Heavy Atoms | 28 |
| Complexity | 981.2055 |
Chemical Identifiers
| CAS Number | 851305-07-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C2=CC=C(O2)/C=C/3\C(=O)N(C(=S)S3)CCC(=O)O |
Product Overview
BAS 01151030 (CAS 851305-07-2), with molecular formula C18H12F3NO4S2 and molecular weight 427.02 g/mol. IUPAC: 3-[(5E)-4-oxo-2-sulfanylidene-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazolidin-3-yl]propanoic acid.
Chemical Property Profile of BAS 01151030
Property Insights of BAS 01151030
The XLogP value of 4.6413 indicates that BAS 01151030 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01151030. Following Lipinski's Rule of Five, BAS 01151030 has 1 hydrogen bond donor(s) and 5 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 01151030?
The CAS number of BAS 01151030 is 851305-07-2.
What is the molecular formula of BAS 01151030?
The molecular formula of BAS 01151030 is C18H12F3NO4S2.
What is the molecular weight of BAS 01151030?
The molecular weight of BAS 01151030 is 427.02 g/mol.
Where can I buy BAS 01151030?
You can request a quote for BAS 01151030 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01151030?
Yes, KEHONG BIO provides custom synthesis services for BAS 01151030 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.