trans-2-[3-n-Propylsulfonyl-4-(2-bromoethoxy)-5-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)tetrahydrofuran

HCID 67907009

Basic information

Standard SMILES
CCCS(=O)(=O)c1cc([C@H]2CC[C@H](c3cc(OC)c(OC)c(OC)c3)O2)cc(OC)c1OCCBr
InChIKey
ZTFGZFZPKWIRGW-RTBURBONSA-N
Molecular formula
C25H33BrO8S
Average molar mass
573.5 g/mol
Monoisotopic mass
572.10795

Names & identifiers

Preferred name
trans-2-[3-n-Propylsulfonyl-4-(2-bromoethoxy)-5-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)tetrahydrofuran
IUPAC
(2R,5R)-2-[4-(2-bromoethoxy)-3-methoxy-5-propylsulfonylphenyl]-5-(3,4,5-trimethoxyphenyl)oxolane

Names & synonyms

SCHEMBL9691737ZTFGZFZPKWIRGW-RTBURBONSA-Ntrans-2-[3 -n-Propylsulfonyl-4-(2-bromoethoxy)-5-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)tetrahydrofurantrans-2-[3-n-Propylsulfonyl-4-(2-bromoethoxy)-5-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)tetrahydrofuran

Database identifiers

PubChem CID
67907009

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
97.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
12
Heavy atoms
35

Related reactions

3 records

Compound notes

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