303144-41-4
Product Name:
5-(4-CHLOROPHENYL)-2-[(PHENYLSULFONYL)METHYL]-3-(2-PYRIDINYLSULFANYL)-2-CYCLOHEXEN-1-ONE
Formula:
C24H20ClNO3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 470.0 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 469.0573135 g/mol |
| Monoisotopic Mass | 469.0573135 g/mol |
| Topological Polar Surface Area | 97.8 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 762 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |