338422-37-0
Product Name:
1-(2-([3-Chloro-5-(trifluoromethyl)-2-pyridinyl]amino)ethyl)-3-[(4-methoxyphenyl)sulfanyl]dihydro-1H-pyrrole-2,5-dione
Formula:
C19H17ClF3N3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 459.9 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 459.0631248 g/mol |
| Monoisotopic Mass | 459.0631248 g/mol |
| Topological Polar Surface Area | 96.8 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 620 |
| 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 |