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5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione structure
Fine Chemical

5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione

TL;DR: 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS 1023845-26-2) is a chemical compound with molecular formula C16H16N2O5S and molecular weight 348.078 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Also Known As: 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione, 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylene}-2,2-dimethyl-1,3-dioxane-4,6-dione, 5-(((6-ethoxybenzo[d]thiazol-2-yl)amino)methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione, 5-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione, F3389-0108

CAS Number
1023845-26-2
Molecular Formula
C16H16N2O5S
Molecular Weight
348.078 g/mol
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Technical Specifications

Molecular FormulaC16H16N2O5S
Molecular Weight348.078 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)115.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds4
Exact Mass348.078 Da
Heavy Atoms24
Complexity529.0
SMILESCCOC1=CC2=C(C=C1)N=C(S2)NC=C3C(=O)OC(OC3=O)(C)C
InChIKeyZINYWPPCKASKSA-UHFFFAOYSA-N

Chemical Property Profile of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione

XLogP
3.6
TPSA (Topological Polar Surface Area)
115.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
4
Heavy Atoms
24
Complexity
529.0
Exact Mass
348.078
Monoisotopic Mass
348.078
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione

The XLogP value of 3.6 indicates that 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione. Following Lipinski's Rule of Five, 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione?

The CAS number of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione is 1023845-26-2.

What is the molecular formula of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione?

The molecular formula of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione is C16H16N2O5S.

What is the molecular weight of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione?

The molecular weight of 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione is 348.078 g/mol.

Where can I buy 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione?

You can request a quote for 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione?

Yes, CoreyChem provides custom synthesis services for 5-{[(6-ethoxy-1,3-benzothiazol-2-yl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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