2-Methyl-1-[(3-phenyl-5-isoxazolyl)methyl]-4-(trifluoromethyl)-1H-indole-5-carbonitrile

HCID 67405441
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Basic information

Standard SMILES
Cc1cc2c(C(F)(F)F)c(C#N)ccc2n1Cc1cc(-c2ccccc2)no1
InChIKey
ICGJFLGGGIOLMJ-UHFFFAOYSA-N
Molecular formula
C21H14F3N3O
Average molar mass
381.3 g/mol
Monoisotopic mass
381.10889656

Names & identifiers

Preferred name
2-Methyl-1-[(3-phenyl-5-isoxazolyl)methyl]-4-(trifluoromethyl)-1H-indole-5-carbonitrile
IUPAC
2-methyl-1-[(3-phenyl-1,2-oxazol-5-yl)methyl]-4-(trifluoromethyl)indole-5-carbonitrile

Names & synonyms

2-Methyl-1-[(3-phenyl-5-isoxazolyl)methyl]-4-(trifluoromethyl)-1H-indole-5-carbonitrileSCHEMBL2432275

Database identifiers

PubChem CID
67405441

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
54.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
28

Related reactions

4 records
New reaction record

Compound notes

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