79333-03-2
Product Name:
Piperazine, 1-(3-(2-ethoxyphenoxy)-3-phenylpropyl)-4-(phenylmethyl)-, hydrochloride, hydrate (1:2:1)
Formula:
C28H34N2O2.2ClH.H2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 503.5 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 10 |
| Exact Mass | 502.2153838 g/mol |
| Monoisotopic Mass | 502.2153838 g/mol |
| Topological Polar Surface Area | 24.9 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 496 |
| 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 | 3 |
| Compound Is Canonicalized | Yes |