Basic information
- Standard SMILES
CCOC(=O)C=Cc1cn(-c2ccccc2)nc1OCc1ccc(OCc2nc(-c3ccco3)oc2C)cc1- InChIKey
XCFXMZKTFGGGTD-UHFFFAOYSA-N- Molecular formula
- C30H27N3O6
- Average molar mass
- 525.6 g/mol
- Monoisotopic mass
- 525.18998559
Names & identifiers
- Preferred name
- Ethyl 3-[3-[[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methoxy]-1-phenylpyrazol-4-yl]prop-2-enoate
- IUPAC
- ethyl 3-[3-[[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methoxy]-1-phenylpyrazol-4-yl]prop-2-enoate
Database identifiers
- PubChem CID
- 91051400
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 12
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 785
Related reactions
2 records
Compound notes
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