Basic information
- CAS
55383-99-8- Standard SMILES
CCOc1ccc(CN2CCC(=O)NC2=O)cc1- InChIKey
AXXKQDRYWZMKRL-UHFFFAOYSA-N- Molecular formula
- C13H16N2O3
- Average molar mass
- 248.28 g/mol
- Monoisotopic mass
- 248.11609238
Names & identifiers
- Preferred name
- 1-((4-Ethoxyphenyl)methyl)dihydro-2,4(1H,3H)-pyrimidinedione
- IUPAC
- 1-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4-dione
Names & synonyms
55383-99-82,4(1H,3H)-Pyrimidinedione, dihydro-1-((4-ethoxyphenyl)methyl)-DTXSID00203938RefChem:1053650DTXCID301264291-((4-Ethoxyphenyl)methyl)dihydro-2,4(1H,3H)-pyrimidinedione1-(4-Ethoxybenzyl)dihydropyrimidine-2,4(1H,3H)-dioneBRN 0797178N'-(4-Ethoxybenzyl)-5,6-dihydrouracilDihydro-1-((4-ethoxyphenyl)methyl)-2,4(1H,3H)-pyrimidinedione1-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4-dioneCambridge id 6590800
Show more names
Oprea1_242091MLS000111173CHEMBL1450876SCHEMBL14341930HMS2403K15MFCD01689459STK651288AKOS001647840
Database identifiers
- CAS
55383-99-8- PubChem CID
- 150653
- DTXSID
DTXSID00203938- ChEMBL
CHEMBL1450876
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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