3-[4-[2-[(E)-2-phenylethenyl]-4-oxazolylmethylthio]phenyl]propanol

HCID 22009683
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Basic information

Standard SMILES
OCCCc1ccc(SCc2coc(/C=C/c3ccccc3)n2)cc1
InChIKey
WIHJZNPVNDETQQ-JLHYYAGUSA-N
Molecular formula
C21H21NO2S
Average molar mass
351.5 g/mol

Names & identifiers

Preferred name
3-[4-[2-[(E)-2-phenylethenyl]-4-oxazolylmethylthio]phenyl]propanol
IUPAC
3-[4-[[2-[(E)-2-phenylethenyl]-1,3-oxazol-4-yl]methylsulfanyl]phenyl]propan-1-ol

Names & synonyms

SCHEMBL5758259WIHJZNPVNDETQQ-JLHYYAGUSA-N3-[4-[2-[(E)-2-phenyl ethenyl]-4-oxazolylmethylthio]phenyl]propanol3-[4-[2-[(E)-2-phenylethenyl]-4-oxazolylmethylthio]phenyl]propanol

Database identifiers

PubChem CID
22009683

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
71.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

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