691868-94-7
Product Name:
3-[(4-FLUOROBENZYL)SULFANYL]-1-(4-METHYLPHENYL)-5,6,7,8-TETRAHYDRO-4-ISOQUINOLINECARBONITRILE
Formula:
C24H21FN2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 388.5 g/mol |
|---|---|
| XLogP3 | 6.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 388.14094801 g/mol |
| Monoisotopic Mass | 388.14094801 g/mol |
| Topological Polar Surface Area | 62 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 544 |
| 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 |