N-benzyl-4-oxo-4-phenylbutanamide
Basic information
- CAS
7510-08-9- Standard SMILES
O=C(CCC(=O)c1ccccc1)NCc1ccccc1- InChIKey
RRGZDQMVNQZKET-UHFFFAOYSA-N- Molecular formula
- C17H17NO2
- Average molar mass
- 267.32 g/mol
- Monoisotopic mass
- 267.12592879
Names & identifiers
- Preferred name
- N-benzyl-4-oxo-4-phenylbutanamide
- IUPAC
- N-benzyl-4-oxo-4-phenylbutanamide
Names & synonyms
N-benzyl-4-oxo-4-phenylbutanamide7510-08-9DTXSID80324216RefChem:363340DTXCID60275333N-benzyl-4-oxo-4-phenyl-butyramideNSC406046ChemDiv3_014059MLS000682618SCHEMBL7167181CHEMBL1375866RRGZDQMVNQZKET-UHFFFAOYSA-N
Show more names
HMS1512P01HMS2742K18AKOS002125980NSC-406046SMR000311975SR-01000077612SR-01000077612-1Z27748222
Database identifiers
- CAS
7510-08-9- PubChem CID
- 347385
- DTXSID
DTXSID80324216- ChEMBL
CHEMBL1375866- Nikkaji
- J467.204F
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 315
Experimental & physicochemical properties
Solubility>40.1 [ug/mL] (The mean of the results at pH 7.4)
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Related reactions
2 records
Compound notes
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