2832-87-3
Product Name:
ETHYL 2-(3-THIOXO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZIN-2-YL)ACETATE
Formula:
C12H13NO2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 267.4 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 267.03877100 g/mol |
| Monoisotopic Mass | 267.03877100 g/mol |
| Topological Polar Surface Area | 95.7 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 309 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |