497943-57-4
Product Name:
prop-2-en-1-yl cyano{3-[4-(2-ethoxyphenyl)piperazin-1-yl]quinoxalin-2-yl}acetate
Formula:
C26H27N5O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 457.5 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 9 |
| Exact Mass | 457.21138974 g/mol |
| Monoisotopic Mass | 457.21138974 g/mol |
| Topological Polar Surface Area | 91.6 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 731 |
| 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 |