Basic information
- Standard SMILES
Cn1nnc(-c2ccccn2)c1COc1ccc(C(=O)NCC(O)C(F)(F)F)cn1- InChIKey
SABKSRUKOLNYRW-UHFFFAOYSA-N- Molecular formula
- C18H17F3N6O3
- Average molar mass
- 422.4 g/mol
- Monoisotopic mass
- 422.13142291
Names & identifiers
- Preferred name
- 6-(3-Methyl-5-pyridin-2-yl-3H-[1,2,3]triazol-4-ylmethoxy)-N-(3,3,3-trifluoro-2-hydroxy-propyl)-nicotinamide
- IUPAC
- 6-[(3-methyl-5-pyridin-2-yltriazol-4-yl)methoxy]-N-(3,3,3-trifluoro-2-hydroxypropyl)pyridine-3-carboxamide
Names & synonyms
6-(3-Methyl-5-pyridin-2-yl-3H-[1,2,3]triazol-4-ylmethoxy)-N-(3,3,3-trifluoro-2-hydroxy-propyl)-nicotinamideSCHEMBL2688061
Database identifiers
- PubChem CID
- 57334792
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 570
Related reactions
1 records
Compound notes
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