Basic information
- CAS
560064-98-4- Standard SMILES
Cc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)c(O)c1- InChIKey
AJYYMECATNUODW-UHFFFAOYSA-N- Molecular formula
- C21H19NO2
- Average molar mass
- 317.4 g/mol
- Monoisotopic mass
- 317.14157885
Names & identifiers
- Preferred name
- N-(2-hydroxy-4-methylphenyl)-2,2-diphenylacetamide
- IUPAC
- N-(2-hydroxy-4-methylphenyl)-2,2-diphenylacetamide
Names & synonyms
N-(2-hydroxy-4-methylphenyl)-2,2-diphenylacetamideMLS001176728CHEMBL1337178DTXSID801333274HMS2901P20AKOS016618150560064-98-4SMR000589938Z33452300
Database identifiers
- CAS
560064-98-4- PubChem CID
- 8094616
- DTXSID
DTXSID801333274- ChEMBL
CHEMBL1337178
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 381
Experimental & physicochemical properties
Solubility2.1 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…