n-Propyl-5-(3-(quinolin-2-ylmethyloxy)benzyloxy)benzoxazole-2-carboxylate
Basic information
- Standard SMILES
CCCOC(=O)c1nc2cc(OCc3cccc(OCc4ccc5ccccc5n4)c3)ccc2o1- InChIKey
UXBPNXGVMPCOSL-UHFFFAOYSA-N- Molecular formula
- C28H24N2O5
- Average molar mass
- 468.5 g/mol
- Monoisotopic mass
- 468.16852187
Names & identifiers
- Preferred name
- n-Propyl-5-(3-(quinolin-2-ylmethyloxy)benzyloxy)benzoxazole-2-carboxylate
- IUPAC
- propyl 5-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]-1,3-benzoxazole-2-carboxylate
Names & synonyms
SCHEMBL9757243UXBPNXGVMPCOSL-UHFFFAOYSA-Nn-propyl-5-(3-(quinolin-2-ylmethyloxy)benzyloxy)-benzoxazole-2-carboxylaten-propyl-5-(3-(quinolin-2-ylmethyloxy)benzyloxy)benzoxazole-2-carboxylate
Database identifiers
- PubChem CID
- 54376787
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 678
Related reactions
3 records
Compound notes
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