4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide
TL;DR: 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide (CAS 80379-72-2) is a chemical compound with molecular formula C19H20N2O4S2 and molecular weight 404.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-morpholin-4-yl-8-phenyl-3,4,5,6-tetrahydrooxathiino[5,6-g][1,3]benzothiazole 2,2-dioxide
Also Known As: 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide, 4-morpholin-4-yl-8-phenyl-3,4,5,6-tetrahydrooxathiino[5,6-g], 4-morpholino-8-phenyl-3,4,5,6-tetrahydrooxathiino[5,6-g][1,3]benzothiazole 2,2-dioxide, 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro[1,2]oxathiino[5,6-g][1,3]benzothiazole 2,2-dioxide, 4-morpholin-4-yl-8-phenyl-3,4,5,6-tetrahydrooxathiino[5,6-g][1,3]benzothiazole 2,2-dioxide
| Molecular Formula | C19H20N2O4S2 |
|---|---|
| Molecular Weight | 404.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.08646 |
| Heavy Atoms | 27 |
| Complexity | 693.0 |
Chemical Identifiers
| CAS Number | 80379-72-2 |
|---|---|
| SMILES | C1CC2=C(C3=C1C(CS(=O)(=O)O3)N4CCOCC4)SC(=N2)C5=CC=CC=C5 |
| InChIKey | PUVHZQOWCLHURM-UHFFFAOYSA-N |
Product Overview
4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide (CAS 80379-72-2), with molecular formula C19H20N2O4S2 and molecular weight 404.09 g/mol. IUPAC: 4-morpholin-4-yl-8-phenyl-3,4,5,6-tetrahydrooxathiino[5,6-g][1,3]benzothiazole 2,2-dioxide.
Chemical Property Profile of 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide
Property Insights of 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide. Following Lipinski's Rule of Five, 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide has 0 hydrogen bond donor(s) and 7 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-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide?
The CAS number of 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide is 80379-72-2.
What is the molecular formula of 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide?
The molecular formula of 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide is C19H20N2O4S2.
What is the molecular weight of 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide?
The molecular weight of 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide is 404.09 g/mol.
Where can I buy 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide?
You can request a quote for 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Morpholinyl)-8-phenyl-3,4,5,6-tetrahydro(1,2)oxathiino(5,6-g)(1,3)benzothiazole 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.