![1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one structure](/static/products/5147/51472-75-4.webp)
1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one
TL;DR: 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one (CAS 51472-75-4) is a chemical compound with molecular formula C10H4Cl2O2S2 and molecular weight 289.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one
Also Known As: 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one, 1,3-Dichloro-8-hydroxy-4H,8H-benzo[1,2-c:4,5-c']bisthiophen-4-one
| Molecular Formula | C10H4Cl2O2S2 |
|---|---|
| Molecular Weight | 289.90 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 289.90298 |
| Heavy Atoms | 16 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 51472-75-4 |
|---|---|
| SMILES | C1=C2C(C3=C(SC(=C3C(=O)C2=CS1)Cl)Cl)O |
| InChIKey | UVKOESDLJAOSKD-UHFFFAOYSA-N |
Product Overview
1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one (CAS 51472-75-4), with molecular formula C10H4Cl2O2S2 and molecular weight 289.90 g/mol. IUPAC: 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one.
Chemical Property Profile of 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one
Property Insights of 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one
The XLogP value of 3.5 indicates that 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one. Following Lipinski's Rule of Five, 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one 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 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one?
The CAS number of 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one is 51472-75-4.
What is the molecular formula of 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one?
The molecular formula of 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one is C10H4Cl2O2S2.
What is the molecular weight of 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one?
The molecular weight of 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one is 289.90 g/mol.
Where can I buy 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one?
You can request a quote for 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dichloro-4-hydroxy-4H-thieno[3,4-f][2]benzothiol-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.