68827-52-1
Product Name:
7H-[1,2,4]Triazolo[5,1-b][1,3]thiazine-5-carboxylic acid, 7-oxo-2-phenyl-, methyl ester
Formula:
C13H9N3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 287.30 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 287.03646233 g/mol |
| Monoisotopic Mass | 287.03646233 g/mol |
| Topological Polar Surface Area | 99.4 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 448 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |