1-methyl-2-(2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-morpholin-4-yl)-1H-[4,4']bipyrimidinyl-6-one
Basic information
- Standard SMILES
Cn1c(N2CCOC(c3nc(-c4ccccc4)no3)C2)nc(-c2ccncn2)cc1=O- InChIKey
WOIABLGCPCZHIM-UHFFFAOYSA-N- Molecular formula
- C21H19N7O3
- Average molar mass
- 417.4 g/mol
- Monoisotopic mass
- 417.15493749
Names & identifiers
- Preferred name
- 1-methyl-2-(2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-morpholin-4-yl)-1H-[4,4']bipyrimidinyl-6-one
- IUPAC
- 3-methyl-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)morpholin-4-yl]-6-pyrimidin-4-ylpyrimidin-4-one
Names & synonyms
SCHEMBL916733WOIABLGCPCZHIM-UHFFFAOYSA-N1-methyl-2-(2-(3-phenyl-[1,2,4]oxadiazol-5-yl)-morpholin-4-yl)-1H-[4,4']bipyrimidinyl-6-one
Database identifiers
- PubChem CID
- 57798788
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 724
Related reactions
5 records
Compound notes
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