85690-03-5
Product Name:
alpha-(4-Cyclopentylphenyl)-1,4-piperazinediethanol (Z)-2-butenedioate (1:2)
Formula:
C30H42N2O2.2C4H4O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 550.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 10 |
| Exact Mass | 550.25264541 g/mol |
| Monoisotopic Mass | 550.25264541 g/mol |
| Topological Polar Surface Area | 196 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 449 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |