Basic information
- CAS
101221-61-8- Standard SMILES
CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1Cc1c[nH]c2ccccc12- InChIKey
KUUMBFIVZDMVRO-UHFFFAOYSA-N- Molecular formula
- C24H28FN3O
- Average molar mass
- 393.5 g/mol
- Monoisotopic mass
- 393.22164069
Names & identifiers
- Preferred name
- 1-(4-Fluorophenyl)-4-(3-((1H-indol-3-yl)methyl)-4-methylpiperazin-1-yl)butan-1-one
- IUPAC
- 1-(4-fluorophenyl)-4-[3-(1H-indol-3-ylmethyl)-4-methylpiperazin-1-yl]butan-1-one
Names & synonyms
DTXSID909060071-(4-Fluorophenyl)-4-{3-[(1H-indol-3-yl)methyl]-4-methylpiperazin-1-yl}butan-1-one101221-61-81-(4-Fluorophenyl)-4-(3-((1H-indol-3-yl)methyl)-4-methylpiperazin-1-yl)butan-1-oneRefChem:1054386DTXCID701335108BRN 56352131-Methyl-2-(3-indolylmethyl)-4-gamma-(p-fluorobenzoyl)propylpiperazine4'-Fluoro-4-(3-(3-indolylmethyl)-4-methyl-1-piperazinyl)butyrophenone1-Butanone, 1-(4-fluorophenyl)-4-(3-(1H-indol-3-ylmethyl)-4-methyl-1-piperazinyl)-83892-87-9BUTYROPHENONE, 4'-FLUORO-4-(3-(3-INDOLYLMETHYL)-4-METHYL-1-PIPERAZINYL)-
Database identifiers
- CAS
101221-61-8、83892-87-9- PubChem CID
- 55183
- DTXSID
DTXSID90906007- Nikkaji
- J77.620C
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 39.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 536
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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