719286-35-8
Product Name:
5-[(E)-1,3-BENZODIOXOL-5-YLMETHYLIDENE]-2-(METHYLSULFANYL)-1,3-THIAZOL-4(5H)-ONE
Formula:
C12H9NO3S2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 279.3 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 279.00238550 g/mol |
| Monoisotopic Mass | 279.00238550 g/mol |
| Topological Polar Surface Area | 98.5 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 422 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |