Basic information
- Standard SMILES
Cc1cc2c(C(F)(F)F)c(C#N)ccc2n1Cc1nnc(-c2cncc(Br)c2)o1- InChIKey
HOUASCOTQVDIFN-UHFFFAOYSA-N- Molecular formula
- C19H11BrF3N5O
- Average molar mass
- 462.2 g/mol
Names & identifiers
- Preferred name
- 1-{[5-(5-Bromo-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl}-2-methyl-4-(trifluoromethyl)-1H-indole-5-carbonitrile
- IUPAC
- 1-[[5-(5-bromo-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-4-(trifluoromethyl)indole-5-carbonitrile
Names & synonyms
1-{[5-(5-Bromo-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl}-2-methyl-4-(trifluoromethyl)-1H-indole-5-carbonitrileSCHEMBL2433279
Database identifiers
- PubChem CID
- 67405754
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 643
Related reactions
3 records
Compound notes
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