2-[4-(Benzyloxy)-2-methoxyphenyl]-1H-benzimidazole
Basic information
- CAS
89469-27-2- Standard SMILES
COc1cc(OCc2ccccc2)ccc1-c1nc2ccccc2[nH]1- InChIKey
VAPXLMAYRILIEL-UHFFFAOYSA-N- Molecular formula
- C21H18N2O2
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.13682782
Names & identifiers
- Preferred name
- 2-[4-(Benzyloxy)-2-methoxyphenyl]-1H-benzimidazole
- IUPAC
- 2-(2-methoxy-4-phenylmethoxyphenyl)-1H-benzimidazole
Names & synonyms
89469-27-22-[4-(Benzyloxy)-2-methoxyphenyl]-1H-benzimidazoleSCHEMBL10745905DTXSID306032602-[4-(Benzyloxy)-2-methoxyphenyl]-1H-1,3-benzimidazole
Database identifiers
- CAS
89469-27-2- PubChem CID
- 20184539
- DTXSID
DTXSID30603260
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 47.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 413
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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