1025633-09-3
Product Name:
2-((TERT-BUTYL)SULFONYL)-3-((2-METHYL(4-QUINOLYL))AMINO)PROP-2-ENENITRILE
Formula:
C17H19N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 329.4 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 329.11979803 g/mol |
| Monoisotopic Mass | 329.11979803 g/mol |
| Topological Polar Surface Area | 91.2 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 604 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |