1797879-13-0
Product Name:
5-[2-[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]ethyl-4-chloro-2-nitrophenol
Formula:
C19H19ClN4O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 418.9 g/mol |
---|---|
XLogP3 | 5.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 4 |
Exact Mass | 418.0866393 g/mol |
Monoisotopic Mass | 418.0866393 g/mol |
Topological Polar Surface Area | 114 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 546 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |