1H-Isoindole-1,3(2H)-dione, 2-((1-((diethylamino)methyl)-1H-benzimidazol-2-yl)methyl)-
Basic information
- CAS
115398-80-6- Standard SMILES
CCN(CC)Cn1c(CN2C(=O)c3ccccc3C2=O)nc2ccccc21- InChIKey
QSCZWBSDYLFPGK-UHFFFAOYSA-N- Molecular formula
- C21H22N4O2
- Average molar mass
- 362.4 g/mol
- Monoisotopic mass
- 362.17427596
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 2-((1-((diethylamino)methyl)-1H-benzimidazol-2-yl)methyl)-
- IUPAC
- 2-[[1-(diethylaminomethyl)benzimidazol-2-yl]methyl]isoindole-1,3-dione
Names & synonyms
1H-Isoindole-1,3(2H)-dione, 2-((1-((diethylamino)methyl)-1H-benzimidazol-2-yl)methyl)-2-((1-((Diethylamino)methyl)-1H-benzimidazol-2-yl)methyl)-1H-isoindole-1,3(2H)-dione115398-80-6DTXSID70151073RefChem:239248DTXCID20735642-({1-[(Diethylamino)methyl]-1H-1,3-benzimidazol-2-yl}methyl)-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
115398-80-6- PubChem CID
- 3087641
- DTXSID
DTXSID70151073
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 540
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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