Basic information
- CAS
56504-51-9- Standard SMILES
Cc1ccc(C=C2C(=O)NC(=O)NC2=O)cc1- InChIKey
NEWBESJIUIWGMS-UHFFFAOYSA-N- Molecular formula
- C12H10N2O3
- Average molar mass
- 230.22 g/mol
- Monoisotopic mass
- 230.06914219
Names & identifiers
- Preferred name
- 5-[(4-Methylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
- IUPAC
- 5-[(4-methylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Names & synonyms
56504-51-95-[(4-methylphenyl)methylidene]-1,3-diazinane-2,4,6-trione5-(4-methylbenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trioneNSC6366002,4,6(1H,3H,5H)-pyrimidinetrione, 5-[(4-methylphenyl)methylene]-5-(4-Methylbenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrioneChemDiv3_002024SCHEMBL28680183DTXSID40327167HMS1478L22STK415226AKOS001616319
Show more names
NSC-636600IDI1_020990ST50170944AB00075760-01AB00075760-03AF-684/002480545-(p-tolylmethylene)hexahydropyrimidine-2,4,6-trioneBRD-K89005485-001-01-0
Database identifiers
- CAS
56504-51-9- PubChem CID
- 367142
- DTXSID
DTXSID40327167- Nikkaji
- J1.289.313B
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 371
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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