338761-20-9
Product Name:
N-ALLYL-8-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-1-OXA-4,8-DIAZASPIRO[4.5]DECANE-4-CARBOTHIOAMIDE
Formula:
C17H20ClF3N4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 420.9 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 420.0998446 g/mol |
| Monoisotopic Mass | 420.0998446 g/mol |
| Topological Polar Surface Area | 72.7 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 557 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |