Basic information
- Standard SMILES
Cc1ccc2c(c1)c(-c1ccc(F)cc1)cn2N1CCN(C)CC1- InChIKey
DEZIQNCPVPFWEE-UHFFFAOYSA-N- Molecular formula
- C20H22FN3
- Average molar mass
- 323.4 g/mol
Names & identifiers
- Preferred name
- 3-(4-Fluorophenyl)-5-methyl-1-(1-methylpiperazin-4-yl)-1H-indole
- IUPAC
- 3-(4-fluorophenyl)-5-methyl-1-(4-methylpiperazin-1-yl)indole
Names & synonyms
CHEMBL141721SCHEMBL9270960DEZIQNCPVPFWEE-UHFFFAOYSA-NBDBM500018103-(4-Fluorophenyl)-5-methyl-1-(1-methylpiperazin-4-yl)-1H-indole3-(4-Fluoro-phenyl)-5-methyl-1-(4-methyl-piperazin-1-yl)-1H-indole
Database identifiers
- PubChem CID
- 10245637
- ChEMBL
CHEMBL141721- Nikkaji
- J527.767A
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 11.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 415
Related reactions
2 records
Compound notes
Loading…