4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione
TL;DR: 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione (CAS 55100-59-9) is a chemical compound with molecular formula C16H12O4S and molecular weight 300.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-1,1-dioxo-2,5-diphenylthiophen-3-one
Also Known As: HOTDO, 4-hydroxy-2,5-diphenylthiophen-3(2h)-one 1,1-dioxide, 2,5-DIPHENYL-4-HYDROXY-3-OXO-2,3-DIHYDROTHIOPHENE 1,1-DIOXIDE, 4-hydroxy-1,1-dioxo-2,5-diphenylthiophen-3-one, 4-Hydroxy-2,5-diphenyl-3(2H)-thiophenone 1,1-dioxide
| Molecular Formula | C16H12O4S |
|---|---|
| Molecular Weight | 300.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.04562 |
| Heavy Atoms | 21 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 55100-59-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(=O)C(=C(S2(=O)=O)C3=CC=CC=C3)O |
| InChIKey | UIVWXNPUCAHAJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione (CAS 55100-59-9), with molecular formula C16H12O4S and molecular weight 300.05 g/mol. IUPAC: 4-hydroxy-1,1-dioxo-2,5-diphenylthiophen-3-one.
Chemical Property Profile of 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione
Property Insights of 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione. Following Lipinski's Rule of Five, 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione has 1 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 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione?
The CAS number of 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione is 55100-59-9.
What is the molecular formula of 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione?
The molecular formula of 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione is C16H12O4S.
What is the molecular weight of 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione?
The molecular weight of 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione is 300.05 g/mol.
Where can I buy 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione?
You can request a quote for 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-2,5-diphenyl-1H-1lambda~6~-thiophene-1,1,3(2H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.