909666-43-9
Product Name:
1-[2-CHLORO-4-METHYL-5-(METHYLSULFONYL)PHENYL]-4-([6-(TRIFLUOROMETHYL)PYRIDIN-3-YL]METHYL)PIPERAZINE
Formula:
C19H21ClF3N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 447.9 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 447.0995103 g/mol |
| Monoisotopic Mass | 447.0995103 g/mol |
| Topological Polar Surface Area | 61.9 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 650 |
| 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 |