(S)-1-chloro-3-(4-(2-(4-((R)-2,3-dihydroxypropoxy)phenyl)propan-2-yl)phenoxy)propan-2-yl acetate

HCID 86293252
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Basic information

Standard SMILES
CC(=O)O[C@H](CCl)COc1ccc(C(C)(C)c2ccc(OC[C@H](O)CO)cc2)cc1
InChIKey
RKDOKWLUDXJNBJ-DENIHFKCSA-N
Molecular formula
C23H29ClO6
Average molar mass
436.9 g/mol

Names & identifiers

Preferred name
(S)-1-chloro-3-(4-(2-(4-((R)-2,3-dihydroxypropoxy)phenyl)propan-2-yl)phenoxy)propan-2-yl acetate
IUPAC
[(2S)-1-chloro-3-[4-[2-[4-[(2R)-2,3-dihydroxypropoxy]phenyl]propan-2-yl]phenoxy]propan-2-yl] acetate

Names & synonyms

SCHEMBL16226951RKDOKWLUDXJNBJ-DENIHFKCSA-N(S)-1-chloro-3-(4-(2-(4-((R)-2,3-dihydroxypropoxy)phenyl)propan-2-yl)phenoxy)propan-2-yl acetate

Database identifiers

PubChem CID
86293252

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
85.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
12
Heavy atoms
30

Related reactions

1 records
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Compound notes

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