80834-68-0
Product Name:
1-Benzyl-6-(3-(4-(3-methylphenyl)-1-piperazinyl)-1-propenyl)-3,4-dihyd rocarbostyril oxalate
Formula:
C2H2O4*C30H33N3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 541.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 541.25767123 g/mol |
| Monoisotopic Mass | 541.25767123 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 750 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |