Basic information
- Standard SMILES
O=C1CCc2cccc(Nc3ncc(-c4ccc(C(F)(F)F)cc4)o3)c2C1- InChIKey
IGGYRYMEBKBTEX-UHFFFAOYSA-N- Molecular formula
- C20H15F3N2O2
- Average molar mass
- 372.3 g/mol
Names & identifiers
- Preferred name
- 8-{5-[4-(Trifluoromethyl)phenyl]oxazol-2-ylamino}-3,4-dihydronaphthalen-2(1H)-one
- IUPAC
- 8-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]-3,4-dihydro-1H-naphthalen-2-one
Names & synonyms
CHEMBL11732638-{5-[4-(Trifluoromethyl)phenyl]oxazol-2-ylamino}-3,4-dihydronaphthalen-2(1H)-oneSCHEMBL1962809BDBM503218358-({5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl}amino)-3,4-dihydronaphthalen-2(1H)-one8-({5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl}amino)-3,4-dihydronaphthalen-2 (1H)-one
Database identifiers
- PubChem CID
- 11955840
- ChEMBL
CHEMBL1173263
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 534
Related reactions
39 records
Compound notes
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