Basic information
- CAS
25262-18-4- Standard SMILES
O=C1C2N=NC(c3ccccc3)C2C(=O)N1c1ccccc1- InChIKey
XAYZXMOZTUNUOK-UHFFFAOYSA-N- Molecular formula
- C17H13N3O2
- Average molar mass
- 291.3 g/mol
- Monoisotopic mass
- 291.10077667
Names & identifiers
- Preferred name
- 3,5-Diphenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3H,5H)-dione
- IUPAC
- 3,5-diphenyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione
Names & synonyms
25262-18-4DTXSID404953103,5-Diphenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3H,5H)-dione
Database identifiers
- CAS
25262-18-4- PubChem CID
- 12378878
- DTXSID
DTXSID40495310
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 62.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 492
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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