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

HCID 22493687

Basic information

Standard SMILES
COc1ccc(-c2nc(COC3CCCC(OCc4cccc(C)c4C(=O)O)C3)c(C)o2)cc1
InChIKey
ZYBRZZCKEGBRNQ-UHFFFAOYSA-N
Molecular formula
C27H31NO6
Average molar mass
465.5 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL4837430ZYBRZZCKEGBRNQ-UHFFFAOYSA-N2-{3-[2-(4-Methoxyphenyl )-5-methyloxazol4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic Acid2-{3-[2-(4-Methoxyphenyl)-5-methyloxazol-4-ylmethoxy]cyclohexyloxymethyl}-6-methylbenzoic Acid

Database identifiers

PubChem CID
22493687

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
91 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
34

Related reactions

3 records

Compound notes

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