Basic information
- CAS
27337-45-7- Standard SMILES
CC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1- InChIKey
UWXLQEOSAWVEHW-UHFFFAOYSA-N- Molecular formula
- C15H12N2O2
- Average molar mass
- 252.27 g/mol
- Monoisotopic mass
- 252.08987763
Names & identifiers
- Preferred name
- N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide
- IUPAC
- N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide
Names & synonyms
N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide27337-45-7N-(4-Benzooxazol-2-yl-phenyl)-acetamiden-(4-(benzo[d]oxazol-2-yl)phenyl)acetamideCambridge id 5250056TimTec1_007046Oprea1_089653Oprea1_389758MLS001212587CHEMBL125970SCHEMBL2247579UWXLQEOSAWVEHW-UHFFFAOYSA-N
Show more names
DTXSID401320710HMS1554A06HMS2830L092-(4'-Acetamidophenyl)benzoxazoleAKOS000638375N-(4-benzoxazol-2-ylphenyl)acetamideNCGC00276955-01SMR000514243
Database identifiers
- CAS
27337-45-7- PubChem CID
- 762785
- DTXSID
DTXSID401320710- ChEMBL
CHEMBL125970- Nikkaji
- J1.079.282G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Experimental & physicochemical properties
Solubility1.3 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
2 records
Compound notes
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