Basic information
- CAS
361992-29-2- Standard SMILES
O=C1CC(=O)N(Cc2ccco2)C(=O)N1- InChIKey
WNSAVOLNDMMVNP-UHFFFAOYSA-N- Molecular formula
- C9H8N2O4
- Average molar mass
- 208.17 g/mol
- Monoisotopic mass
- 208.04840674
Names & identifiers
- Preferred name
- 1-(Furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
- IUPAC
- 1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
Names & synonyms
1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione361992-29-2DTXSID40367482RefChem:226696DTXCID903185201-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trioneMLS-0015433.0001regid4260569Cambridge id 6722914Oprea1_623946Oprea1_707974MLS000062734
Show more names
1-(2-furfuryl)barbituric acidSCHEMBL2115613CHEMBL1403497BDBM46141cid_2269367HMS1586B21HMS2383G06STL371821
Database identifiers
- CAS
361992-29-2- PubChem CID
- 2269367
- DTXSID
DTXSID40367482- ChEMBL
CHEMBL1403497
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 79.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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