Basic information
- Standard SMILES
Cn1c(N2CCOC(c3noc(-c4ccccc4)n3)C2)nc(-c2ccncn2)cc1=O- InChIKey
JTCYBSRIYFGACM-UHFFFAOYSA-N- Molecular formula
- C21H19N7O3
- Average molar mass
- 417.4 g/mol
Names & identifiers
- Preferred name
- 1-methyl-2-[2-(5-phenyl-[1,2,4]oxadiazol-3-yl)-morpholin-4-yl]-1H-[4,4']bipyrimidinyl-6-one
- IUPAC
- 3-methyl-2-[2-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]-6-pyrimidin-4-ylpyrimidin-4-one
Names & synonyms
SCHEMBL917178JTCYBSRIYFGACM-UHFFFAOYSA-N1-methyl-2-[2-(5-phenyl-[1,2,4]oxadiazol-3-yl)-morpholin-4-yl]-1H-[4,4']bipyrimidinyl-6-one
Database identifiers
- PubChem CID
- 57798787
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
Loading…