2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one
TL;DR: 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one (CAS 16810-65-4) is a chemical compound with molecular formula C16H22O2S2 and molecular weight 310.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one
Also Known As: 3,3'-bis[5-tert-butyl-2(5H)-thiophenone], AI-942/13332087, 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one
| Molecular Formula | C16H22O2S2 |
|---|---|
| Molecular Weight | 310.11 g/mol |
| LogP | 4.2154 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 310.1061 |
| Heavy Atoms | 20 |
| Complexity | 467.5754 |
Chemical Identifiers
| CAS Number | 16810-65-4 |
|---|---|
| SMILES | CC(C)(C)C1C=C(C(=O)S1)C2=CC(SC2=O)C(C)(C)C |
Product Overview
2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one (CAS 16810-65-4), with molecular formula C16H22O2S2 and molecular weight 310.11 g/mol. IUPAC: 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one.
Chemical Property Profile of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one
Property Insights of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one
The XLogP value of 4.2154 indicates that 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one?
The CAS number of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one is 16810-65-4.
What is the molecular formula of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one?
The molecular formula of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one is C16H22O2S2.
What is the molecular weight of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one?
The molecular weight of 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one is 310.11 g/mol.
Where can I buy 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one?
You can request a quote for 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2-tert-butyl-4-(2-tert-butyl-5-oxo-2H-thiophen-4-yl)-2H-thiophen-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.