861209-36-1
Product Name:
3-(BENZYLSULFANYL)-1-(2-FLUOROPHENYL)-5,6,7,8-TETRAHYDRO-4-ISOQUINOLINECARBONITRILE
Formula:
C23H19FN2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 374.5 g/mol |
|---|---|
| XLogP3 | 6 |
| 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 | 526 |
| 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 |