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Basic information
- Standard SMILES
CC(=O)c1ccc(Cn2cc(NC(=O)c3ncoc3-c3cccc(C(F)(F)F)n3)cn2)o1- InChIKey
YWPNIVFVVRFIRP-UHFFFAOYSA-N- Molecular formula
- C20H14F3N5O4
- Average molar mass
- 445.4 g/mol
- Monoisotopic mass
- 445.09978843
Names & identifiers
- Preferred name
- 5-(6-Trifluoromethyl-pyridin-2-yl)-oxazole-4-carboxylic acid [1-(5-acetyl-furan-2-ylmethyl)-1H-pyrazol-4-yl]-amide
- IUPAC
- N-[1-[(5-acetylfuran-2-yl)methyl]pyrazol-4-yl]-5-[6-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole-4-carboxamide
Names & synonyms
5-(6-Trifluoromethyl-pyridin-2-yl)-oxazole-4-carboxylic acid [1-(5-acetyl-furan-2-ylmethyl)-1H-pyrazol-4-yl]-amideSCHEMBL1166260
Database identifiers
- PubChem CID
- 66928343
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 697
Related reactions
1 records
Compound notes
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