321433-54-9
Product Name:
1-Benzyl-3-[(4-chlorophenyl)sulfanyl]-4-(4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino)dihydro-1H-pyrrole-2,5-dione
Formula:
C27H23Cl2F3N4O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 595.5 g/mol |
|---|---|
| XLogP3 | 6.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Exact Mass | 594.0870870 g/mol |
| Monoisotopic Mass | 594.0870870 g/mol |
| Topological Polar Surface Area | 82 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 865 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |