5-(3-Methoxy-phenyl)-2-methyl-oxazole-4-carboxylic acid {1-[5-(1,1-difluoro-ethyl)-furan-2-ylmethyl]-1H-pyrazol-4-yl}-amide

HCID 66928522
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Basic information

Standard SMILES
COc1cccc(-c2oc(C)nc2C(=O)Nc2cnn(Cc3ccc(C(C)(F)F)o3)c2)c1
InChIKey
JLVTXFLJIIMSEI-UHFFFAOYSA-N
Molecular formula
C22H20F2N4O4
Average molar mass
442.4 g/mol
Monoisotopic mass
442.14526146

Names & identifiers

Preferred name
5-(3-Methoxy-phenyl)-2-methyl-oxazole-4-carboxylic acid {1-[5-(1,1-difluoro-ethyl)-furan-2-ylmethyl]-1H-pyrazol-4-yl}-amide
IUPAC
N-[1-[[5-(1,1-difluoroethyl)furan-2-yl]methyl]pyrazol-4-yl]-5-(3-methoxyphenyl)-2-methyl-1,3-oxazole-4-carboxamide

Names & synonyms

5-(3-Methoxy-phenyl)-2-methyl-oxazole-4-carboxylic acid {1-[5-(1,1-difluoro-ethyl)-furan-2-ylmethyl]-1H-pyrazol-4-yl}-amideSCHEMBL1166493

Database identifiers

PubChem CID
66928522

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
95.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
32

Related reactions

2 records
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Compound notes

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