791521-96-5
Product Name:
FLUPENTIXOL IMPURITY D
Formula:
C25H29F3N2O2S
Synonyms:
2-{2-{4-{3-[(EZ)-2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl}piperazin-1-yl}ethoxy}ethanol
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COMPUTED DESCRIPTORS
| Molecular Weight | 478.6 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 8 |
| Exact Mass | 478.19018383 g/mol |
| Monoisotopic Mass | 478.19018383 g/mol |
| Topological Polar Surface Area | 61.2 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 640 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |