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Thieno[2,3-c]isoquinoline 4-oxide
TL;DR: Thieno[2,3-c]isoquinoline 4-oxide (CAS 106561-70-0) is a chemical compound with molecular formula C11H7NOS and molecular weight 201.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxidothieno[2,3-c]isoquinolin-4-ium
Also Known As: thieno[2,3-c]isoquinoline 4-oxide, 4-oxidothieno[2,3-c]isoquinolin-4-ium, thiopheno[2,3-c]isoquinolin-4-ol, AI-942/25034800
| Molecular Formula | C11H7NOS |
|---|---|
| Molecular Weight | 201.02 g/mol |
| LogP | 2.6879 |
| Topological Polar Surface Area | 26.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.02484 |
| Heavy Atoms | 14 |
| Complexity | 614.7866 |
Chemical Identifiers
| CAS Number | 106561-70-0 |
|---|---|
| SMILES | C1=CC=C2C3=C([N+](=CC2=C1)[O-])SC=C3 |
Product Overview
Thieno[2,3-c]isoquinoline 4-oxide (CAS 106561-70-0), with molecular formula C11H7NOS and molecular weight 201.02 g/mol. IUPAC: 4-oxidothieno[2,3-c]isoquinolin-4-ium.
Chemical Property Profile of Thieno[2,3-c]isoquinoline 4-oxide
Property Insights of Thieno[2,3-c]isoquinoline 4-oxide
The XLogP value of 2.6879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thieno[2,3-c]isoquinoline 4-oxide. With a topological polar surface area (TPSA) of 26.94 Ų, Thieno[2,3-c]isoquinoline 4-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thieno[2,3-c]isoquinoline 4-oxide has 0 hydrogen bond donor(s) and 2 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 Thieno[2,3-c]isoquinoline 4-oxide?
The CAS number of Thieno[2,3-c]isoquinoline 4-oxide is 106561-70-0.
What is the molecular formula of Thieno[2,3-c]isoquinoline 4-oxide?
The molecular formula of Thieno[2,3-c]isoquinoline 4-oxide is C11H7NOS.
What is the molecular weight of Thieno[2,3-c]isoquinoline 4-oxide?
The molecular weight of Thieno[2,3-c]isoquinoline 4-oxide is 201.02 g/mol.
Where can I buy Thieno[2,3-c]isoquinoline 4-oxide?
You can request a quote for Thieno[2,3-c]isoquinoline 4-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thieno[2,3-c]isoquinoline 4-oxide?
Yes, KEHONG BIO provides custom synthesis services for Thieno[2,3-c]isoquinoline 4-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.