2-[3-(2,5-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]sulfanylpropane-1,3-diol

HCID 178477451
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Basic information

Standard SMILES
CC(SC(CO)CO)C(O)(Cn1cncn1)c1cc(F)ccc1F
InChIKey
MGEYVWPMVHCZSH-UHFFFAOYSA-N
Molecular formula
C15H19F2N3O3S
Average molar mass
359.4 g/mol
Monoisotopic mass
359.11151897

Names & identifiers

IUPAC
2-[3-(2,5-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]sulfanylpropane-1,3-diol

Database identifiers

PubChem CID
22462828

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
117 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
24

Related reactions

2 records
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Compound notes

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