Basic information
- Standard SMILES
Cc1ccc(N2CCN(CCNCc3cc(-c4ccccc4)n(-c4ccccc4)n3)CC2)c(C)c1- InChIKey
JXXPRQWUOJFDJJ-UHFFFAOYSA-N- Molecular formula
- C30H35N5
- Average molar mass
- 465.6 g/mol
- Monoisotopic mass
- 465.28924614
Names & identifiers
- Preferred name
- 3-{2-[4-(2,4-Dimethyl phenyl)piperazin-1-yl]ethyl}aminomethyl-1,5-diphenylpyrazole
- IUPAC
- 2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-N-[(1,5-diphenylpyrazol-3-yl)methyl]ethanamine
Names & synonyms
SCHEMBL4246030JXXPRQWUOJFDJJ-UHFFFAOYSA-N3-{2-[4-(2,4-dimethyl phenyl)piperazin-1-yl]ethyl}aminomethyl-1,5-diphenylpyrazole
Database identifiers
- PubChem CID
- 16038562
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 608
Related reactions
2 records
Compound notes
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