850229-64-0
Product Name:
2-(4-bromophenyl)-7-methoxy-1'-methylsulfonylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Formula:
C22H24BrN3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 506.4 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 505.06709 g/mol |
| Monoisotopic Mass | 505.06709 g/mol |
| Topological Polar Surface Area | 79.8 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 800 |
| 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 |