439096-88-5
Product Name:
3-(1,3-BENZODIOXOL-5-YL)-3-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)PROPANOIC ACID
Formula:
C14H17NO6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 327.35 g/mol |
|---|---|
| XLogP3 | -2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 327.07765844 g/mol |
| Monoisotopic Mass | 327.07765844 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 502 |
| 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 |