Basic information
- Standard SMILES
Cc1oc(-c2ccco2)nc1COc1ccc(COc2nn(-c3ccccc3)cc2CO)cc1- InChIKey
BHBCYMUHPGAMEK-UHFFFAOYSA-N- Molecular formula
- C26H23N3O5
- Average molar mass
- 457.5 g/mol
- Monoisotopic mass
- 457.16377084
Names & identifiers
- Preferred name
- {3-[(4-{[2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}benzyl)oxy]-1-phenyl-1H-pyrazol-4-yl}methanol
- IUPAC
- [3-[[4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methoxy]-1-phenylpyrazol-4-yl]methanol
Names & synonyms
SCHEMBL4850671BHBCYMUHPGAMEK-UHFFFAOYSA-N{3-[(4-{[2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}benzyl)oxy]-1-phenyl-1H-pyrazol-4-yl}methanol
Database identifiers
- PubChem CID
- 69217031
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 613
Related reactions
2 records
Compound notes
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