Basic information
- CAS
63376-35-2- Standard SMILES
O=C(Nc1ccccc1)n1[nH]c(=O)n(-c2ccccc2)c1=O- InChIKey
VYOPQSJWBHYPOC-UHFFFAOYSA-N- Molecular formula
- C15H12N4O3
- Average molar mass
- 296.28 g/mol
- Monoisotopic mass
- 296.09094026
Names & identifiers
- Preferred name
- 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide
- IUPAC
- 3,5-dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide
Names & synonyms
NSC6911313,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide63376-35-2SCHEMBL9473147CHEMBL1985896DTXSID00327825NSC-691131NCI60_032723
Database identifiers
- CAS
63376-35-2- PubChem CID
- 391645
- DTXSID
DTXSID00327825- ChEMBL
CHEMBL1985896- Nikkaji
- J525.919C
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 456
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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