BAS 00534489
TL;DR: BAS 00534489 (CAS 304894-53-9) is a chemical compound with molecular formula C24H20ClN3O2S3 and molecular weight 513.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide
Also Known As: BAS 00534489, BIM-0026832.P001, 3-[5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[5-(3-methylbenzyl)-1,3-thiazol-2-yl]propanamide, (Z)-3-(5-(2-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(5-(3-methylbenzyl)thiazol-2-yl)propanamide, 3-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[5-(3-methylbenzyl)-1,3-thiazol-2-yl]propanamide
| Molecular Formula | C24H20ClN3O2S3 |
|---|---|
| Molecular Weight | 513.04 g/mol |
| LogP | 5.92572 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.0406 |
| Heavy Atoms | 33 |
| Complexity | 1255.0112 |
Chemical Identifiers
| CAS Number | 304894-53-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CC2=CN=C(S2)NC(=O)CCN3C(=O)/C(=C/C4=CC=CC=C4Cl)/SC3=S |
Product Overview
BAS 00534489 (CAS 304894-53-9), with molecular formula C24H20ClN3O2S3 and molecular weight 513.04 g/mol. IUPAC: 3-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide.
Chemical Property Profile of BAS 00534489
Property Insights of BAS 00534489
The XLogP value of 5.92572 indicates that BAS 00534489 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00534489. Following Lipinski's Rule of Five, BAS 00534489 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00534489?
The CAS number of BAS 00534489 is 304894-53-9.
What is the molecular formula of BAS 00534489?
The molecular formula of BAS 00534489 is C24H20ClN3O2S3.
What is the molecular weight of BAS 00534489?
The molecular weight of BAS 00534489 is 513.04 g/mol.
Where can I buy BAS 00534489?
You can request a quote for BAS 00534489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00534489?
Yes, KEHONG BIO provides custom synthesis services for BAS 00534489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.