2-(2-Chloro-phenoxy)-4-(5-hydroxymethyl-imidazol-1-ylmethyl)-benzonitrile Hydrochloride
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Basic information
- Standard SMILES
Cl.N#Cc1ccc(Cn2cncc2CO)cc1Oc1ccccc1Cl- InChIKey
ADLNFUHXYYFSTB-UHFFFAOYSA-N- Molecular formula
- C18H15Cl2N3O2
- Average molar mass
- 376.2 g/mol
Names & identifiers
- Preferred name
- 2-(2-Chloro-phenoxy)-4-(5-hydroxymethyl-imidazol-1-ylmethyl)-benzonitrile Hydrochloride
- IUPAC
- 2-(2-chlorophenoxy)-4-[[5-(hydroxymethyl)imidazol-1-yl]methyl]benzonitrile;hydrochloride
Names & synonyms
SCHEMBL7980481ADLNFUHXYYFSTB-UHFFFAOYSA-N2-(2-Chloro-phenoxy)-4-(5-hydroxymethyl-imidazol-1-ylmethyl)-benzonitrile Hydrochloride
Database identifiers
- PubChem CID
- 21697045
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 455
Related reactions
2 records
Compound notes
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