84916-34-7
Product Name:
Cyclohexanecarboxylic acid, 1-((2,5-dioxo-1-pyrrolidinyl)methyl)-2-(4- (2-pyridinyl)-1-piperazinyl)ethyl ester, (Z)-2-butenedioate (1:1)
Formula:
C23H32N4O4.C4H4O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 544.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 10 |
| Exact Mass | 544.25331412 g/mol |
| Monoisotopic Mass | 544.25331412 g/mol |
| Topological Polar Surface Area | 158 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 747 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |