Basic information
- Standard SMILES
N#Cc1ccc2c(cc(C3CC3)n2Cc2noc(-c3cc(C(F)(F)F)ccn3)n2)c1C(F)(F)F- InChIKey
SLRROKIFPFLAIT-UHFFFAOYSA-N- Molecular formula
- C22H13F6N5O
- Average molar mass
- 477.4 g/mol
- Monoisotopic mass
- 477.10242903
Names & identifiers
- Preferred name
- 2-Cyclopropyl-4-(trifluoromethyl)-1-({5-[4-(trifluoromethyl)-2-pyridinyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-indole-5-carbonitrile
- IUPAC
- 2-cyclopropyl-4-(trifluoromethyl)-1-[[5-[4-(trifluoromethyl)-2-pyridinyl]-1,2,4-oxadiazol-3-yl]methyl]indole-5-carbonitrile
Names & synonyms
2-Cyclopropyl-4-(trifluoromethyl)-1-({5-[4-(trifluoromethyl)-2-pyridinyl]-1,2,4-oxadiazol-3-yl}methyl)-1H-indole-5-carbonitrileSCHEMBL2435625
Database identifiers
- PubChem CID
- 86620719
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 795
Related reactions
3 records
Compound notes
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