89652-26-6
Product Name:
3(2H)-Isoquinolinone, 1,4-dihydro-1-(4-nitrophenyl)-2-(phenylmethyl)-
Formula:
C22H18N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 358.4 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 358.13174244 g/mol |
| Monoisotopic Mass | 358.13174244 g/mol |
| Topological Polar Surface Area | 66.1 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 532 |
| 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 |