BAS 00757148
TL;DR: BAS 00757148 (CAS 5738-36-3) is a chemical compound with molecular formula C16H9ClN2O6S2 and molecular weight 423.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5E)-5-[[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Also Known As: BAS 00757148, AB00095340-01, (5-{[5-(4-chloro-3-nitrophenyl)-2-furyl]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)acetic acid, [(5E)-5-{[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid, 2-[(5E)-5-[[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
| Molecular Formula | C16H9ClN2O6S2 |
|---|---|
| Molecular Weight | 423.96 g/mol |
| LogP | 3.794 |
| Topological Polar Surface Area | 113.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.95905 |
| Heavy Atoms | 27 |
| Complexity | 1016.0895 |
Chemical Identifiers
| CAS Number | 5738-36-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=CC=C(O2)/C=C/3\C(=O)N(C(=S)S3)CC(=O)O)[N+](=O)[O-])Cl |
Product Overview
BAS 00757148 (CAS 5738-36-3), with molecular formula C16H9ClN2O6S2 and molecular weight 423.96 g/mol. IUPAC: 2-[(5E)-5-[[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid.
Chemical Property Profile of BAS 00757148
Property Insights of BAS 00757148
The XLogP value of 3.794 indicates that BAS 00757148 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 00757148. Following Lipinski's Rule of Five, BAS 00757148 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 00757148?
The CAS number of BAS 00757148 is 5738-36-3.
What is the molecular formula of BAS 00757148?
The molecular formula of BAS 00757148 is C16H9ClN2O6S2.
What is the molecular weight of BAS 00757148?
The molecular weight of BAS 00757148 is 423.96 g/mol.
Where can I buy BAS 00757148?
You can request a quote for BAS 00757148 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00757148?
Yes, KEHONG BIO provides custom synthesis services for BAS 00757148 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.