Basic information
- CAS
5807-93-2- Standard SMILES
CCOc1ccc(Nc2cc(=O)n(C)c(=O)n2C)cc1- InChIKey
PTILCRWUPPYWLH-UHFFFAOYSA-N- Molecular formula
- C14H17N3O3
- Average molar mass
- 275.3 g/mol
- Monoisotopic mass
- 275.12699141
Names & identifiers
- Preferred name
- 6-(4-Ethoxyanilino)-1,3-dimethylpyrimidine-2,4-dione
- IUPAC
- 6-(4-ethoxyanilino)-1,3-dimethylpyrimidine-2,4-dione
Names & synonyms
6-(4-ethoxyanilino)-1,3-dimethylpyrimidine-2,4-dione6-[(4-ethoxyphenyl)amino]-1,3-dimethylpyrimidine-2,4(1H,3H)-dioneMLS000109029CBMicro_034216Cambridge id 5807932Oprea1_013420Oprea1_724547CHEMBL1330290DTXSID10973650HMS2188K22STK385029AKOS000625471
Show more names
SMR000104976BIM-0034059.P001EU-0071354ST50247552AG-690/13156956SR-01000431384SR-01000431384-16-(4-Ethoxyanilino)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
5807-93-2- PubChem CID
- 760883
- DTXSID
DTXSID10973650- ChEMBL
CHEMBL1330290
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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