1422060-46-5
Product Name:
rel-(3aS,7R,8aS)-2-phenethyloctahydro-3a,7-epoxyisothiazolo[4,5-c]azepine 1,1-dioxide
Formula:
C15H20N2O3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 308.4 g/mol |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 308.11946368 g/mol |
| Monoisotopic Mass | 308.11946368 g/mol |
| Topological Polar Surface Area | 67 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 498 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |