Basic information
- Standard SMILES
O=Cc1ccc(-c2c(-c3ccc(Cl)cc3)ccn3c(=O)n(Cc4ccc(C(F)(F)F)nc4)nc23)cc1- InChIKey
MORVLBLLIJEJFY-UHFFFAOYSA-N- Molecular formula
- C26H16ClF3N4O2
- Average molar mass
- 508.9 g/mol
Names & identifiers
- Preferred name
- 4-(7-(4-Chlorophenyl)-3-oxo-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)benzaldehyde
- IUPAC
- 4-[7-(4-chlorophenyl)-3-oxo-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]benzaldehyde
Names & synonyms
4-(7-(4-chlorophenyl)-3-oxo-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridin-8-yl)benzaldehydeSCHEMBL4469734
Database identifiers
- PubChem CID
- 57799463
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 65.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 949
Related reactions
4 records
Linked notes
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