488094-38-8
Product Name:
9-bromo-2',2'-dimethyl-2-thiophen-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-oxane]
Formula:
C20H21BrN2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 433.4 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 432.05071 g/mol |
| Monoisotopic Mass | 432.05071 g/mol |
| Topological Polar Surface Area | 62.3 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 600 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |