1,2-Diphenyl-4-carbamoyl-3,5-pyrazolidinedione
Basic information
- CAS
6126-32-5- Standard SMILES
NC(=O)C1C(=O)N(c2ccccc2)N(c2ccccc2)C1=O- InChIKey
ICHVKKIWXKQXFR-UHFFFAOYSA-N- Molecular formula
- C16H13N3O3
- Average molar mass
- 295.29 g/mol
- Monoisotopic mass
- 295.09569129
Names & identifiers
- Preferred name
- 1,2-Diphenyl-4-carbamoyl-3,5-pyrazolidinedione
- IUPAC
- 3,5-dioxo-1,2-diphenylpyrazolidine-4-carboxamide
Names & synonyms
KIS82D1KFH1,2-DIPHENYL-4-CARBAMOYL-3,5-PYRAZOLIDINEDIONEUNII-KIS82D1KFH3,5-Dioxo-1,2-diphenyl-4-pyrazolidinecarboxamide4-Pyrazolidinecarboxamide, 3,5-dioxo-1,2-diphenyl-6126-32-5RefChem:196720
Database identifiers
- CAS
6126-32-5- PubChem CID
- 22501
- UNII
- KIS82D1KFH
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 431
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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