![3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one structure](/static/products/1327/132794-02-6.webp)
3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one
TL;DR: 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one (CAS 132794-02-6) is a chemical compound with molecular formula C17H14O4S and molecular weight 314.06128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2-methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one
Also Known As: 4H-1-Benzothiopyran-4-one,2,3-dihydro-3-[(2-methoxyphenyl)methylene]-, 1,1-dioxide, (Z)- (9CI), (Z)-2,3-Dihydro-3-((2-methoxyphenyl)methylene)-4H-1-benzothiopyran-4-one 1,1-dioxide, 4H-1-Benzothiopyran-4-one, 2,3-dihydro-3-((2-methoxyphenyl)methylene)-, 1,1-dioxide, (Z)-
Technical Specifications
| Molecular Formula | C17H14O4S |
| Molecular Weight | 314.06128 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 68.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.06128 Da |
| Heavy Atoms | 22 |
| Complexity | 558.0 |
| SMILES | COC1=CC=CC=C1C=C2CS(=O)(=O)C3=CC=CC=C3C2=O |
| InChIKey | OJYKFKKTLXEUFG-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one
Property Insights of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one. Following Lipinski's Rule of Five, 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one?
The CAS number of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one is 132794-02-6.
What is the molecular formula of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one?
The molecular formula of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one is C17H14O4S.
What is the molecular weight of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one?
The molecular weight of 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one is 314.06128 g/mol.
Where can I buy 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one?
You can request a quote for 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one?
Yes, CoreyChem provides custom synthesis services for 3-[(2-Methoxyphenyl)methylidene]-1,1-dioxothiochromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.