Basic information
- CAS
139223-25-9- Standard SMILES
c1cc2nc(Cc3nc4ccc(C5=NCCN5)cc4[nH]3)[nH]c2cc1C1=NCCN1- InChIKey
NAJDTUYYOLRLRP-UHFFFAOYSA-N- Molecular formula
- C21H20N8
- Average molar mass
- 384.4 g/mol
- Monoisotopic mass
- 384.18109267
Names & identifiers
- Preferred name
- 2,2'-Methylenebis(5-(4,5-dihydro-1H-imidazol-2-yl)-1H-benzimidazole)
- IUPAC
- 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[[6-(4,5-dihydro-1H-imidazol-2-yl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazole
Names & synonyms
139223-25-92,2'-Methylenebis(5-(4,5-dihydro-1H-imidazol-2-yl)-1H-benzimidazole)CHEMBL48475SCHEMBL9029139SCHEMBL14259704DTXSID00930398Bis[5-(imidazolin-2-yl)benzimidazolyl)methane2,2'-Methylenebis[6-(4,5-dihydro-1H-imidazol-2-yl)-1H-benzimidazole]2,2'-Methylenebis[6-(4,5-dihydro-1H-imidazol-2-yl)-1H-1,3-benzimidazole]5-(4,5-dihydro-1H-imidazol-2-yl)-2-[[5-(4,5-dihydro-1H-imidazol-2-yl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazole
Database identifiers
- CAS
139223-25-9- PubChem CID
- 456166
- DTXSID
DTXSID00930398- ChEMBL
CHEMBL48475- Nikkaji
- J604.840D
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 622
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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