Bionet1_001931
TL;DR: Bionet1_001931 (CAS 105623-82-3) is a chemical compound with molecular formula C14H11ClO3S4 and molecular weight 389.92795 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-2-sulfanylidene-1,3-dithiole-4-carboxylate
Also Known As: Bionet1_001931, ethyl 5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-2-thioxo-1,3-dithiole-4-carboxylate, 5H-012, ethyl 5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-2-sulfanylidene-1,3-dithiole-4-carboxylate, ethyl 5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-2-sulfanylidene-2H-1,3-dithiole-4-carboxylate
Technical Specifications
| Molecular Formula | C14H11ClO3S4 |
| Molecular Weight | 389.92795 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 151.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.92795 Da |
| Heavy Atoms | 22 |
| Complexity | 498.0 |
| SMILES | CCOC(=O)C1=C(SC(=S)S1)SCC(=O)C2=CC=C(C=C2)Cl |
| InChIKey | FAUJULXEZZQLRA-UHFFFAOYSA-N |
Chemical Property Profile of Bionet1_001931
Property Insights of Bionet1_001931
The XLogP value of 5.2 indicates that Bionet1_001931 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting Bionet1_001931 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bionet1_001931 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bionet1_001931?
The CAS number of Bionet1_001931 is 105623-82-3.
What is the molecular formula of Bionet1_001931?
The molecular formula of Bionet1_001931 is C14H11ClO3S4.
What is the molecular weight of Bionet1_001931?
The molecular weight of Bionet1_001931 is 389.92795 g/mol.
Where can I buy Bionet1_001931?
You can request a quote for Bionet1_001931 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bionet1_001931?
Yes, CoreyChem provides custom synthesis services for Bionet1_001931 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.