74667-82-6
Product Name:
1-Piperazinepropanol, 4-(10,11-dihydro-8-(methylsulfonyl)dibenzo(b,f)t hiepin-10-yl)-, 1-oxide
Formula:
C22H28N2O4S2
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COMPUTED DESCRIPTORS
Molecular Weight | 448.6 g/mol |
---|---|
XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 5 |
Exact Mass | 448.14904973 g/mol |
Monoisotopic Mass | 448.14904973 g/mol |
Topological Polar Surface Area | 109 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 675 |
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 |