Basic information
- CAS
115410-51-0- Standard SMILES
Cc1cccc(N2CCN(Cn3c(CN4C(=O)c5ccccc5C4=O)nc4ccccc43)CC2)c1- InChIKey
RQRCJFYDZSZZQG-UHFFFAOYSA-N- Molecular formula
- C28H27N5O2
- Average molar mass
- 465.5 g/mol
- Monoisotopic mass
- 465.21647512
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 2-((1-((4-(3-methylphenyl)-1-piperazinyl)methyl)-1H-benzimidazol-2-yl)methyl)-
- IUPAC
- 2-[[1-[[4-(3-methylphenyl)piperazin-1-yl]methyl]benzimidazol-2-yl]methyl]isoindole-1,3-dione
Names & synonyms
115410-51-01H-Isoindole-1,3(2H)-dione, 2-((1-((4-(3-methylphenyl)-1-piperazinyl)methyl)-1H-benzimidazol-2-yl)methyl)-DTXSID30151094RefChem:239239DTXCID50735852-[(1-{[4-(3-Methylphenyl)piperazin-1-yl]methyl}-1H-1,3-benzimidazol-2-yl)methyl]-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
115410-51-0- PubChem CID
- 3087656
- DTXSID
DTXSID30151094
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 759
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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