(4R,5R)-4,5-Dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyl-4-oxazolemethanol

HCID 14760451
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Basic information

Standard SMILES
CS(=O)(=O)c1ccc(C2OC(c3ccccc3)=NC2CO)cc1
InChIKey
BOCXPQQPWOKDFW-UHFFFAOYSA-N
Molecular formula
C17H17NO4S
Average molar mass
331.4 g/mol
Monoisotopic mass
331.0878292

Names & identifiers

Preferred name
(4R,5R)-4,5-Dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyl-4-oxazolemethanol
IUPAC
[5-(4-methylsulfonylphenyl)-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]methanol

Names & synonyms

(4R,5R)-4,5-Dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyl-4-oxazolemethanolMFCD290661631357626-00-6SCHEMBL1844104[5-(4-methylsulfonylphenyl)-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]methanol[5-(4-methylsulfonylphenyl)-2-phenyl-4,5-dihydrooxazol-4-yl]methanol4,5-Dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyl-4-oxazolemethanol4,5-Dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyl-4-oxazolemethanol, 97%(4R-trans)-4,5-Dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyl-4-oxazolemethanol; D-threo-4,5-Dihydro-5-(4-methylsulfonylphenyl)-2-phenyl-4-oxazole-methanol;

Database identifiers

PubChem CID
14760451

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
84.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
23

Related reactions

2 records
New reaction record

Compound notes

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