[4-[(E)-inden-1-ylidenemethyl]phenyl]urea
Basic information
- CAS
28439-96-5- Standard SMILES
NC(=O)Nc1ccc(/C=C2\C=Cc3ccccc32)cc1- InChIKey
IHCKIQWKCHGQNB-SDNWHVSQSA-N- Molecular formula
- C17H14N2O
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.11061307
Names & identifiers
- Preferred name
- [4-[(E)-inden-1-ylidenemethyl]phenyl]urea
- IUPAC
- [4-[(E)-inden-1-ylidenemethyl]phenyl]urea
Names & synonyms
28439-96-5Urea,N-[4-(1H-inden-1-ylidenemethyl)phenyl]-[4-[(E)-inden-1-ylidenemethyl]phenyl]ureaNSC132579CHEMBL1900703SMSSF-0625527AMS_CNC_ID-343140637NSC-132579NCGC00188171-01NCGC00188171-02N-[4-(1H-inden-1-ylidenemethyl)phenyl]ureaAT-051/43422727
Database identifiers
- CAS
28439-96-5- PubChem CID
- 6509052
- ChEMBL
CHEMBL1900703
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 419
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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