799798-63-3
Product Name:
isopropyl 2-(3-(4-benzhydrylpiperazin-1-yl)quinoxalin-2-yl)-2-cyanoacetate
Formula:
C31H31N5O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 505.6 g/mol |
|---|---|
| XLogP3 | 5.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 505.24777525 g/mol |
| Monoisotopic Mass | 505.24777525 g/mol |
| Topological Polar Surface Area | 82.4 Ų |
| Heavy Atom Count | 38 |
| Formal Charge | 0 |
| Complexity | 788 |
| 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 |