Basic information
- CAS
5301-41-7- Standard SMILES
CN1C(=O)C(=Cc2cccc3ccccc23)C(=O)N(C)C1=O- InChIKey
ASWNTWJFKRCDNA-UHFFFAOYSA-N- Molecular formula
- C17H14N2O3
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.10044231
Names & identifiers
- Preferred name
- ST50557994
- IUPAC
- 1,3-dimethyl-5-(naphthalen-1-ylmethylidene)-1,3-diazinane-2,4,6-trione
Names & synonyms
5301-41-7ST50557994DTXSID60345126RefChem:381628DTXCID602962001,3-Dimethyl-5-(1-naphthylmethylene)-2,4,6(1H,3H,5H)-pyrimidinetrione1,3-dimethyl-5-[(naphthalen-1-yl)methylidene]-1,3-diazinane-2,4,6-trione172023-39-11,3-dimethyl-5-(naphthalen-1-ylmethylidene)-1,3-diazinane-2,4,6-trioneSCHEMBL15044620ASWNTWJFKRCDNA-UHFFFAOYSA-NSTK043657
Show more names
AKOS000518192EBC-291148Z442990291,3-Dimethyl-5-(1-naphthylmethylene)-2,4,6(1H,3H,5H)-pyrimidinetrione #1,3-dimethyl-5-(naphthylmethylene)-1,3-dihydropyrimidine-2,4,6-trione1,3-dimethyl-5-(naphthalen-1-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trionePyrimidine-2,4,6(1H,3H,5H)-trione, 1,3-dimethyl-5-(1-naphthylmethylene)-
Database identifiers
- CAS
5301-41-7- PubChem CID
- 602001
- DTXSID
DTXSID60345126- Nikkaji
- J2.173.446B
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 514
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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