Basic information
- Standard SMILES
CC(C)(C)COc1ccc2c(c1)C1(COC(N)=N1)c1cc(-c3ccccn3)ccc1O2- InChIKey
GIYVJINEXDOFJS-UHFFFAOYSA-N- Molecular formula
- C25H25N3O3
- Average molar mass
- 415.5 g/mol
Names & identifiers
- Preferred name
- 2'-(2,2-dimethylpropoxy)-7'-pyridin-2-ylspiro[5H-1,3-oxazole-4,9'-xanthene]-2-amine
- IUPAC
- 2'-(2,2-dimethylpropoxy)-7'-pyridin-2-ylspiro[5H-1,3-oxazole-4,9'-xanthene]-2-amine
Names & synonyms
SCHEMBL1990875
Database identifiers
- PubChem CID
- 67239486
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 79 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 677
Related reactions
1 records
Compound notes
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