pimozide
3-[1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl]-1H-benzimidazol-2-one
| Molecular Formula | C28H29F2N3O |
|---|---|
| Molecular Weight | 461.5 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 35.6 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.22787 |
| Heavy Atoms | 34 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 2062-78-4 |
|---|---|
| SMILES | C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F |
| InChIKey | YVUQSNJEYSNKRX-UHFFFAOYSA-N |
📖 Product Overview
pimozide (CAS: 2062-78-4) is a chemical compound with molecular formula C28H29F2N3O and molecular weight 461.5 g/mol. Its IUPAC systematic name is 3-[1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl]-1H-benzimidazol-2-one.
YVUQSNJEYSNKRX-UHFFFAOYSA-N.
SMILES: C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F.
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