352000-01-2
Product Name:
N-[4-(AMINOSULFONYL)-2,1,3-BENZOXADIAZOL-7-YL]-2-AMINOETHYL METHANETHIOSULFONATE
Formula:
C9H12N4O5S3
Synonyms:
ABD-MTS
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COMPUTED DESCRIPTORS
| Molecular Weight | 352.4 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 6 |
| Exact Mass | 351.99698302 g/mol |
| Monoisotopic Mass | 351.99698302 g/mol |
| Topological Polar Surface Area | 186 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 570 |
| 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 |