RefChem:1059528
TL;DR: RefChem:1059528 (CAS 107887-97-8) is a chemical compound with molecular formula C38H30N4O4S2 and molecular weight 670.17084 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4E)-1-(4-methylphenyl)-4-[[2-[[(E)-[1-(4-methylphenyl)-4,5-dioxo-2-sulfanylidenepyrrolidin-3-ylidene]-phenylmethyl]amino]ethylamino]-phenylmethylidene]-5-sulfanylidenepyrrolidine-2,3-dione
Also Known As: 2,3-Pyrrolidinedione, 4,4'-(1,2-ethanediylbis(imino(phenylmethylidyne)))bis(1-(4-methylphenyl)-5-thioxo-, (4E)-1-(4-methylphenyl)-4-[[2-[[(E)-[1-(4-methylphenyl)-4,5-dioxo-2-sulfanylidenepyrrolidin-3-ylidene]-phenylmethyl]amino]ethylamino]-phenylmethylidene]-5-sulfanylidenepyrrolidine-2,3-dione
Technical Specifications
| Molecular Formula | C38H30N4O4S2 |
| Molecular Weight | 670.17084 g/mol |
| XLogP | 8.3 |
| Topological Polar Surface Area (TPSA) | 163.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 670.17084 Da |
| Heavy Atoms | 48 |
| Complexity | 1270.0 |
| SMILES | CC1=CC=C(C=C1)N2C(=S)/C(=C(/NCCN/C(=C\3/C(=S)N(C(=O)C3=O)C4=CC=C(C=C4)C)/C5=CC=CC=C5)\C6=CC=CC=C6)/C(=O)C2=O |
| InChIKey | WJQUXOWOKSNLSA-JWTBXLROSA-N |
Chemical Property Profile of RefChem:1059528
Property Insights of RefChem:1059528
The XLogP value of 8.3 indicates that RefChem:1059528 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 163.0 Ų indicates high polarity, suggesting RefChem:1059528 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1059528 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1059528?
The CAS number of RefChem:1059528 is 107887-97-8.
What is the molecular formula of RefChem:1059528?
The molecular formula of RefChem:1059528 is C38H30N4O4S2.
What is the molecular weight of RefChem:1059528?
The molecular weight of RefChem:1059528 is 670.17084 g/mol.
Where can I buy RefChem:1059528?
You can request a quote for RefChem:1059528 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1059528?
Yes, CoreyChem provides custom synthesis services for RefChem:1059528 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.