BAS 00660727
TL;DR: BAS 00660727 (CAS 301229-53-8) is a chemical compound with molecular formula C17H9Cl3N2O2S2 and molecular weight 441.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(5Z)-5-[(2,4-dichlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Also Known As: BAS 00660727, BIM-0022903.P001, AF-399/36752001, 2-chloro-N-[(5Z)-5-[(2,4-dichlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide, 2-chloro-N-[5-(2,4-dichlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
| Molecular Formula | C17H9Cl3N2O2S2 |
|---|---|
| Molecular Weight | 441.92 g/mol |
| LogP | 5.193 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 441.9171 |
| Heavy Atoms | 26 |
| Complexity | 962.77423 |
Chemical Identifiers
| CAS Number | 301229-53-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NN2C(=O)/C(=C/C3=C(C=C(C=C3)Cl)Cl)/SC2=S)Cl |
Product Overview
BAS 00660727 (CAS 301229-53-8), with molecular formula C17H9Cl3N2O2S2 and molecular weight 441.92 g/mol. IUPAC: 2-chloro-N-[(5Z)-5-[(2,4-dichlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide.
Chemical Property Profile of BAS 00660727
Property Insights of BAS 00660727
The XLogP value of 5.193 indicates that BAS 00660727 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 00660727 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00660727 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00660727?
The CAS number of BAS 00660727 is 301229-53-8.
What is the molecular formula of BAS 00660727?
The molecular formula of BAS 00660727 is C17H9Cl3N2O2S2.
What is the molecular weight of BAS 00660727?
The molecular weight of BAS 00660727 is 441.92 g/mol.
Where can I buy BAS 00660727?
You can request a quote for BAS 00660727 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00660727?
Yes, KEHONG BIO provides custom synthesis services for BAS 00660727 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.