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Basic information
- Standard SMILES
COCCn1c(-c2ccc(C(C)C)cc2)nc2c(Br)c(C(O)c3ccccc3OC)cc(OC)c21- InChIKey
VOUVCAWRBBLICB-UHFFFAOYSA-N- Molecular formula
- C28H31BrN2O4
- Average molar mass
- 539.5 g/mol
Names & identifiers
- Preferred name
- [4-Bromo-2-(4-isopropyl-phenyl)-7-methoxy-1-(2-methoxy-ethyl)-1H-benzoimidazol-5-yl]-(2-methoxy-phenyl)-methanol
- IUPAC
- [4-bromo-7-methoxy-1-(2-methoxyethyl)-2-(4-propan-2-ylphenyl)benzimidazol-5-yl]-(2-methoxyphenyl)methanol
Names & synonyms
SCHEMBL2496009VOUVCAWRBBLICB-UHFFFAOYSA-N[4-Bromo-2-(4-isopropyl-phenyl)-7-methoxy-1-(2-methoxy-ethyl)-1H-benzoimidazol-5-yl]-(2-methoxy-phenyl)-methanol
Database identifiers
- PubChem CID
- 57772081
Properties
Computed structural propertiesFilling in
- XLogP
- 5.5
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 646
Related reactions
2 records
Compound notes
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