Basic information
- Standard SMILES
CC(O)Cn1ncc(-c2ccncc2)c1-c1ccc(OCc2ccc3ccccc3n2)cc1- InChIKey
OMRQGOHJLIKRNJ-UHFFFAOYSA-N- Molecular formula
- C27H24N4O2
- Average molar mass
- 436.5 g/mol
Names & identifiers
- Preferred name
- 1-{4-Pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)-phenyl]-pyrazol-1-yl}-propan-2-ol
- IUPAC
- 1-[4-pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyrazol-1-yl]propan-2-ol
Names & synonyms
SCHEMBL3271376SCHEMBL30123165OMRQGOHJLIKRNJ-UHFFFAOYSA-N1-{4-Pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)-phenyl]-pyrazol-1-yl}-propan-2-ol
Database identifiers
- PubChem CID
- 11669263
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 593
Related reactions
2 records
Compound notes
Loading…