rhodanine derivative, 45
TL;DR: rhodanine derivative, 45 (CAS 1204732-35-3) is a chemical compound with molecular formula C23H18ClN3O3S3 and molecular weight 515.0199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-5-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: rhodanine derivative, 45, F0170-0269, (Z)-5-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-2-thioxothiazolidin-4-one, 3-[(5Z)-5-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-1lambda6-thiolane-1,1-dione, (5Z)-5-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Technical Specifications
| Molecular Formula | C23H18ClN3O3S3 |
| Molecular Weight | 515.0199 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 515.0199 Da |
| Heavy Atoms | 33 |
| Complexity | 908.0 |
| SMILES | C1CS(=O)(=O)CC1N2C(=O)/C(=C/C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5)/SC2=S |
| InChIKey | AMPOUGCJFWSGHJ-NDENLUEZSA-N |
Chemical Property Profile of rhodanine derivative, 45
Property Insights of rhodanine derivative, 45
The XLogP value of 4.8 indicates that rhodanine derivative, 45 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for rhodanine derivative, 45. Following Lipinski's Rule of Five, rhodanine derivative, 45 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of rhodanine derivative, 45?
The CAS number of rhodanine derivative, 45 is 1204732-35-3.
What is the molecular formula of rhodanine derivative, 45?
The molecular formula of rhodanine derivative, 45 is C23H18ClN3O3S3.
What is the molecular weight of rhodanine derivative, 45?
The molecular weight of rhodanine derivative, 45 is 515.0199 g/mol.
Where can I buy rhodanine derivative, 45?
You can request a quote for rhodanine derivative, 45 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for rhodanine derivative, 45?
Yes, CoreyChem provides custom synthesis services for rhodanine derivative, 45 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.