906008-94-4
Product Name:
Deshydroxy Bicalutamide
Formula:
C18H14F4N2O3S
Synonyms:
4-Amino-2-(trifluoromethyl)benzonitrile;4-Cyano-3-trifluoromethylaniline
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COMPUTED DESCRIPTORS
| Molecular Weight | 414.4 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 414.06612613 g/mol |
| Monoisotopic Mass | 414.06612613 g/mol |
| Topological Polar Surface Area | 95.4 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 703 |
| 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 |