BAS 00534068
TL;DR: BAS 00534068 (CAS 299952-72-0) is a chemical compound with molecular formula C21H20N2O4S2 and molecular weight 428.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-3-[(5E)-5-[(3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide
Also Known As: BAS 00534068, BIM-0023568.P001, N-(4-methoxyphenyl)-3-[(5E)-5-[(3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide, (E)-3-(5-(3-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(4-methoxyphenyl)propanamide, 3-[(5E)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-methoxyphenyl)propanamide
| Molecular Formula | C21H20N2O4S2 |
|---|---|
| Molecular Weight | 428.09 g/mol |
| LogP | 3.9338 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.08646 |
| Heavy Atoms | 29 |
| Complexity | 957.4084 |
Chemical Identifiers
| CAS Number | 299952-72-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CCN2C(=O)/C(=C\C3=CC(=CC=C3)OC)/SC2=S |
Product Overview
BAS 00534068 (CAS 299952-72-0), with molecular formula C21H20N2O4S2 and molecular weight 428.09 g/mol. IUPAC: N-(4-methoxyphenyl)-3-[(5E)-5-[(3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide.
Chemical Property Profile of BAS 00534068
Property Insights of BAS 00534068
The XLogP value of 3.9338 indicates that BAS 00534068 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00534068. Following Lipinski's Rule of Five, BAS 00534068 has 1 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 00534068?
The CAS number of BAS 00534068 is 299952-72-0.
What is the molecular formula of BAS 00534068?
The molecular formula of BAS 00534068 is C21H20N2O4S2.
What is the molecular weight of BAS 00534068?
The molecular weight of BAS 00534068 is 428.09 g/mol.
Where can I buy BAS 00534068?
You can request a quote for BAS 00534068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00534068?
Yes, KEHONG BIO provides custom synthesis services for BAS 00534068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.