N-[4-(6-acetamido-1,3-benzoxazol-2-yl)phenyl]acetamide
Basic information
- CAS
330448-78-7- Standard SMILES
CC(=O)Nc1ccc(-c2nc3ccc(NC(C)=O)cc3o2)cc1- InChIKey
YSGXXYJFHRXIBR-UHFFFAOYSA-N- Molecular formula
- C17H15N3O3
- Average molar mass
- 309.32 g/mol
- Monoisotopic mass
- 309.11134135
Names & identifiers
- Preferred name
- N-[4-(6-acetamido-1,3-benzoxazol-2-yl)phenyl]acetamide
- IUPAC
- N-[4-(6-acetamido-1,3-benzoxazol-2-yl)phenyl]acetamide
Names & synonyms
N-[4-(6-acetamido-1,3-benzoxazol-2-yl)phenyl]acetamide330448-78-7MLS001210971N-[2-(4-Acetylamino-phenyl)-benzooxazol-6-yl]-acetamideSMR000514032N-{4-[6-(acetylamino)-1,3-benzoxazol-2-yl]phenyl}acetamideCambridge id 5181219Oprea1_339898Oprea1_602000CBDivE_011387cid_831341CHEMBL1588572
Show more names
BDBM100108DTXSID101320709HMS2867E05HMS3523I01STK845085AKOS000600339NCGC00307768-01AB00074957-01
Database identifiers
- CAS
330448-78-7- PubChem CID
- 831341
- DTXSID
DTXSID101320709- ChEMBL
CHEMBL1588572
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 448
Experimental & physicochemical properties
Solubility2.2 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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