Basic information
- CAS
55807-53-9- Standard SMILES
CNC(=O)Nc1cc(-c2ccccc2)on1- InChIKey
WBJPLDPJZYDOIO-UHFFFAOYSA-N- Molecular formula
- C11H11N3O2
- Average molar mass
- 217.22 g/mol
- Monoisotopic mass
- 217.0851266
Names & identifiers
- Preferred name
- N-Methyl-N'-(5-phenyl-1,2-oxazol-3-yl)urea
- IUPAC
- 1-methyl-3-(5-phenyl-1,2-oxazol-3-yl)urea
Names & synonyms
55807-53-9SCHEMBL6391428CHEMBL3276962DTXSID90494838N-Methyl-N'-(5-phenyl-1,2-oxazol-3-yl)urea
Database identifiers
- CAS
55807-53-9- PubChem CID
- 12371359
- DTXSID
DTXSID90494838- ChEMBL
CHEMBL3276962
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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