![(E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione structure](/static/products/312/31237-44-2.png)
(E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione
TL;DR: (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione (CAS 31237-44-2) is a chemical compound with molecular formula C22H20O4S2 and molecular weight 412.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-(3-oxo-6-propan-2-yloxy-1-benzothiophen-2-ylidene)-6-propan-2-yloxy-1-benzothiophen-3-one
Also Known As: (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione, (2E)-2-(3-oxo-6-propan-2-yloxy-1-benzothiophen-2-ylidene)-6-propan-2-yloxy-1-benzothiophen-3-one
| Molecular Formula | C22H20O4S2 |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 5.7496 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.0803 |
| Heavy Atoms | 28 |
| Complexity | 939.69196 |
Chemical Identifiers
| CAS Number | 31237-44-2 |
|---|---|
| SMILES | CC(C)OC1=CC2=C(C=C1)C(=O)/C(=C\3/C(=O)C4=C(S3)C=C(C=C4)OC(C)C)/S2 |
Product Overview
(E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione (CAS 31237-44-2), with molecular formula C22H20O4S2 and molecular weight 412.08 g/mol. IUPAC: (2E)-2-(3-oxo-6-propan-2-yloxy-1-benzothiophen-2-ylidene)-6-propan-2-yloxy-1-benzothiophen-3-one.
Chemical Property Profile of (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione
Property Insights of (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione
The XLogP value of 5.7496 indicates that (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione has 0 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 (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione?
The CAS number of (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione is 31237-44-2.
What is the molecular formula of (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione?
The molecular formula of (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione is C22H20O4S2.
What is the molecular weight of (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione?
The molecular weight of (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione is 412.08 g/mol.
Where can I buy (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione?
You can request a quote for (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-6,6'-diisopropoxy-3H,3'H-[2,2'-bibenzo[b]thiophenylidene]-3,3'-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.