methyl 3-[1-[4-(2,5-dimethyl-4-oxazolylmethoxy)benzyl]3-phenyl-1H-pyrazol-4-yl]propionate

HCID 69427136
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Basic information

Standard SMILES
COC(=O)CCc1cn(Cc2ccc(OCc3nc(C)oc3C)cc2)nc1-c1ccccc1
InChIKey
FKLGRIAJBXPXHL-UHFFFAOYSA-N
Molecular formula
C26H27N3O4
Average molar mass
445.5 g/mol

Names & identifiers

Preferred name
methyl 3-[1-[4-(2,5-dimethyl-4-oxazolylmethoxy)benzyl]3-phenyl-1H-pyrazol-4-yl]propionate
IUPAC
methyl 3-[1-[[4-[(2,5-dimethyl-1,3-oxazol-4-yl)methoxy]phenyl]methyl]-3-phenylpyrazol-4-yl]propanoate

Names & synonyms

SCHEMBL5397444FKLGRIAJBXPXHL-UHFFFAOYSA-Nmethyl 3-[1-[4-(2,5-dimethyl-4-oxazolylmethoxy)benzyl]3-phenyl-1H-pyrazol-4-yl]propionate

Database identifiers

PubChem CID
69427136

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
79.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
33

Related reactions

4 records
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Compound notes

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