Basic information
- CAS
188299-91-4- Standard SMILES
COc1c(-c2nc3ccc(N4CCN(C)CC4)cc3[nH]2)cc(OC)c2c1nc(CO)n2C- InChIKey
RKTORUZJTSNHIX-UHFFFAOYSA-N- Molecular formula
- C23H28N6O3
- Average molar mass
- 436.5 g/mol
- Monoisotopic mass
- 436.22228878
Names & identifiers
- Preferred name
- 4',7'-Dimethoxy-1'-methyl-5-(4-methyl-1-piperazinyl)-(2,5'-bi-1H-benzimidazole)-2'-methanol
- IUPAC
- [4,7-dimethoxy-1-methyl-5-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]benzimidazol-2-yl]methanol
Names & synonyms
188299-91-44',7'-Dimethoxy-1'-methyl-5-(4-methyl-1-piperazinyl)-(2,5'-bi-1H-benzimidazole)-2'-methanol(4',7'-Dimethoxy-1'-methyl-6-(4-methylpiperazin-1-yl)-1H,1'H-[2,5'-bibenzo[d]imidazol]-2'-yl)methanolDTXSID20172177[4',7'-Dimethoxy-1'-methyl-6-(4-methylpiperazin-1-yl)-1H,1'H-[2,5'-bi-1,3-benzimidazol]-2'-yl]methanol
Database identifiers
- CAS
188299-91-4- PubChem CID
- 3045334
- DTXSID
DTXSID20172177
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 635
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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