N-[2-(1H-imidazol-5-yl)ethyl]-4-phenylbenzamide
Basic information
- CAS
322763-28-0- Standard SMILES
O=C(NCCc1cnc[nH]1)c1ccc(-c2ccccc2)cc1- InChIKey
PGTCXULNTZOCOX-UHFFFAOYSA-N- Molecular formula
- C18H17N3O
- Average molar mass
- 291.3 g/mol
- Monoisotopic mass
- 291.13716217
Names & identifiers
- Preferred name
- N-[2-(1H-imidazol-5-yl)ethyl]-4-phenylbenzamide
- IUPAC
- N-[2-(1H-imidazol-5-yl)ethyl]-4-phenylbenzamide
Names & synonyms
MLS001216213N-[2-(1H-imidazol-5-yl)ethyl]-4-phenylbenzamideSCHEMBL1394015CHEMBL1552686DTXSID701330877HMS2867A22STK591490AKOS005513563AKOS016838802322763-28-0SMR000544492N-[2-(1H-imidazol-5-yl)ethyl]biphenyl-4-carboxamide
Show more names
N-[2-(1H-Imidazol-5-yl)ethyl][1,1'-biphenyl]-4-carboxamideN-(2-(1H-imidazol-4-yl)ethyl)-[1,1'-biphenyl]-4-carboxamide
Database identifiers
- CAS
322763-28-0- PubChem CID
- 7694012
- DTXSID
DTXSID701330877- ChEMBL
CHEMBL1552686
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 346
Experimental & physicochemical properties
Solubility28.2 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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