Basic information
- Standard SMILES
CC(Cc1ccccc1)C(=O)Nc1ccc2oc(-c3ccncc3)nc2c1- InChIKey
ZDTMGMWJGMCODV-UHFFFAOYSA-N- Molecular formula
- C22H19N3O2
- Average molar mass
- 357.4 g/mol
- Monoisotopic mass
- 357.14772686
Names & identifiers
- Preferred name
- 2-methyl-3-phenyl-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]propanamide
- IUPAC
- 2-methyl-3-phenyl-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)propanamide
Names & synonyms
CHEMBL2348632SCHEMBL15569860ZDTMGMWJGMCODV-UHFFFAOYSA-NBDBM504327692-methyl-3-phenyl-N-(2-(pyridine-4-yl)benzo[d]oxazol-5-yl)propanamide2-methyl-3-phenyl-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]propanamide
Database identifiers
- PubChem CID
- 71662586
- ChEMBL
CHEMBL2348632
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 488
Related reactions
1 records
Compound notes
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