439096-94-3
Product Name:
3-[(3-FLUOROBENZYL)SULFANYL]-1-(2-METHYLPHENYL)-6,7-DIHYDRO-5H-CYCLOPENTA[C]PYRIDINE-4-CARBONITRILE
Formula:
C23H19FN2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 374.5 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 374.12529795 g/mol |
| Monoisotopic Mass | 374.12529795 g/mol |
| Topological Polar Surface Area | 62 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 546 |
| 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 |