Basic information
- Standard SMILES
N#Cc1ccc(N(C(=O)Nc2ccccc2)n2ccnc2)cc1- InChIKey
PIHBAPVKCWMJTL-UHFFFAOYSA-N- Molecular formula
- C17H13N5O
- Average molar mass
- 303.32 g/mol
- Monoisotopic mass
- 303.11201006
Names & identifiers
- Preferred name
- N-(4-cyanopheny)-N-(1H-imidazol-1-yl)-N'-phenylurea
- IUPAC
- 1-(4-cyanophenyl)-1-imidazol-1-yl-3-phenylurea
Names & synonyms
SCHEMBL5474421PIHBAPVKCWMJTL-UHFFFAOYSA-NN-(4-cyanopheny)-N-(1H-imidazol-1-yl)-N'-phenylurea
Database identifiers
- PubChem CID
- 69455384
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 445
Related reactions
1 records
Compound notes
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