Droperidol

Chemical Information
Droperidol is an organofluorine compound that is haloperidol in which the hydroxy group has been eliminated with the introduction of a double bond in the piperidine ring, and the 4-chlorophenyl group has been replaced by a benzimidazol-2-on-1-yl group. It is used in the management of chemotherapy-induced nausea and vomiting, and in conjunction with an opioid analgesic such as fentanyl to maintain the patient in a calm state of neuroleptanalgesia with indifference to surroundings but still able to cooperate with the surgeon. It has a role as a dopaminergic antagonist, an antiemetic, an anaesthesia adjuvant and a first generation antipsychotic. It is a member of benzimidazoles, an organofluorine compound and an aromatic ketone.
| CAS Number | 548-73-2 |
| PubChem CID | 3168 |
| IUPAC Name | 3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimidazol-2-one |
| Molecular Formula | C22H22FN3O2 |
| Molecular Weight | 379.4 |
| XLogP | 3.5 |
| Topological Polar Surface Area | 52.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 615 |
| Property | Value |
|---|---|
| Molecular Weight | 379.4 |
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 379.16960512 |
| Monoisotopic Mass | 379.16960512 |
| Topological Polar Surface Area | 52.7 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 615 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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