RefChem:1065973
TL;DR: RefChem:1065973 (CAS 107788-20-5) is a chemical compound with molecular formula C25H21BrN2O4S and molecular weight 524.0405 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4Z)-4-[[3-[(4-bromophenyl)sulfanylmethyl]-5-ethoxy-4-hydroxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione
Also Known As: 3,5-Pyrazolidinedione, 4-((3-(((4-bromophenyl)thio)methyl)-5-ethoxy-4-hydroxyphenyl)methylene)-1-phenyl-, (4Z)-4-[[3-[(4-bromophenyl)sulfanylmethyl]-5-ethoxy-4-hydroxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione
Technical Specifications
| Molecular Formula | C25H21BrN2O4S |
| Molecular Weight | 524.0405 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 524.0405 Da |
| Heavy Atoms | 33 |
| Complexity | 721.0 |
| SMILES | CCOC1=CC(=CC(=C1O)CSC2=CC=C(C=C2)Br)/C=C\3/C(=O)NN(C3=O)C4=CC=CC=C4 |
| InChIKey | YKADMZUSLGGORF-BKUYFWCQSA-N |
Chemical Property Profile of RefChem:1065973
Property Insights of RefChem:1065973
The XLogP value of 5.5 indicates that RefChem:1065973 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1065973. Following Lipinski's Rule of Five, RefChem:1065973 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1065973?
The CAS number of RefChem:1065973 is 107788-20-5.
What is the molecular formula of RefChem:1065973?
The molecular formula of RefChem:1065973 is C25H21BrN2O4S.
What is the molecular weight of RefChem:1065973?
The molecular weight of RefChem:1065973 is 524.0405 g/mol.
Where can I buy RefChem:1065973?
You can request a quote for RefChem:1065973 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1065973?
Yes, CoreyChem provides custom synthesis services for RefChem:1065973 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.