2-{3-[2-(3-Methylphenyl)-5-methyloxazol-4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic Acid

HCID 22493650
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Basic information

Standard SMILES
Cc1cccc(-c2nc(COC3CCCC(OCc4cccc(C)c4C(=O)O)C3)c(C)o2)c1
InChIKey
LJORSFTTYZAUNN-UHFFFAOYSA-N
Molecular formula
C27H31NO5
Average molar mass
449.5 g/mol

Names & identifiers

Preferred name
2-{3-[2-(3-Methylphenyl)-5-methyloxazol-4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic Acid
IUPAC
2-methyl-6-[[3-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methoxy]cyclohexyl]oxymethyl]benzoic acid

Names & synonyms

SCHEMBL4826799LJORSFTTYZAUNN-UHFFFAOYSA-N2-{3-[2-(3-Methylphenyl)-5-methyloxazol-4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic Acid

Database identifiers

PubChem CID
22493650

Properties

Computed structural properties

XLogP
5
Topological polar surface area
81.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
33

Related reactions

3 records
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Compound notes

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