Basic information
- Standard SMILES
COc1ccccc1NC=C1C(=O)N(c2ccccc2)N=C1C- InChIKey
GRYZFJGULDNDRN-UHFFFAOYSA-N- Molecular formula
- C18H17N3O2
- Average molar mass
- 307.3 g/mol
- Monoisotopic mass
- 307.13207679
Names & identifiers
- IUPAC
- 4-[(2-methoxyanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one
Database identifiers
- PubChem CID
- 6740109
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 494
Related reactions
2 records
Compound notes
Loading…