1002404-73-0
Product Name:
Imidazo[1,5-a]pyrazin-3(2H)-one, hexahydro-2-[3-[(trifluoromethyl)thio]phenyl]-, hydrochloride (1:1)
Formula:
C13H14F3N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 353.79 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 353.0576455 g/mol |
| Monoisotopic Mass | 353.0576455 g/mol |
| Topological Polar Surface Area | 60.9 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 407 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |