Basic information
- Standard SMILES
COc1ccc(Cc2cc(NC=C3C(=O)Nc4ccccc43)n[nH]2)cc1- InChIKey
WNQGIMYMONUEOL-UHFFFAOYSA-N- Molecular formula
- C20H18N4O2
- Average molar mass
- 346.4 g/mol
- Monoisotopic mass
- 346.14297583
Names & identifiers
- IUPAC
- 3-[[[5-[(4-methoxyphenyl)methyl]-1H-pyrazol-3-yl]amino]methylidene]-1H-indol-2-one
Database identifiers
- PubChem CID
- 69220403
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 79 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 530
Related reactions
4 records
Compound notes
Loading…