1332724-03-4
Product Name:
Citalopram Related Compound B
Formula:
C22H23FN2O6
Synonyms:
1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-3-hydroxy-1,3-dihydroisobenzofuran-5-carbonitrile oxalate
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COMPUTED DESCRIPTORS
| Molecular Weight | 430.4 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Exact Mass | 430.15401462 g/mol |
| Monoisotopic Mass | 430.15401462 g/mol |
| Topological Polar Surface Area | 131 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 569 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |