Basic information
- Standard SMILES
Cc1oc(-c2ccco2)nc1COc1ccc(COc2nn(Cc3ccccc3)cc2CO)cc1Cl- InChIKey
VBGWHYLQYAURGY-UHFFFAOYSA-N- Molecular formula
- C27H24ClN3O5
- Average molar mass
- 505.9 g/mol
Names & identifiers
- Preferred name
- {1-benzyl-3-[(3-chloro-4-{[2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}benzyl)oxy]-1H-pyrazol-4-yl]methanol
- IUPAC
- [1-benzyl-3-[[3-chloro-4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]methoxy]pyrazol-4-yl]methanol
Names & synonyms
{1-benzyl-3-[(3-chloro-4-{[2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}benzyl)oxy]-1H-pyrazol-4-yl]methanol{1-benzyl-3-[(3-chloro-4-{[2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}benzyl)oxy]-1H-pyrazol-4-yl}methanolSCHEMBL4850393VBGWHYLQYAURGY-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 69216916
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 671
Related reactions
4 records
Compound notes
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