(E)-2-{3-[4-({6-[(5R)-5-(2,2-Dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]hexyl}oxy)butyl]phenyl}-N-methylethenesulfonamide

HCID 69199403

Basic information

Standard SMILES
CNS(=O)(=O)/C=C/c1cccc(CCCCOCCCCCCN2C[C@@H](c3ccc4c(c3)COC(C)(C)O4)OC2=O)c1
InChIKey
RSVZTDKTUVPABQ-HCMPGTLISA-N
Molecular formula
C32H44N2O7S
Average molar mass
600.8 g/mol
Monoisotopic mass
600.28692292

Names & identifiers

Preferred name
(E)-2-{3-[4-({6-[(5R)-5-(2,2-Dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]hexyl}oxy)butyl]phenyl}-N-methylethenesulfonamide
IUPAC
(E)-2-[3-[4-[6-[(5R)-5-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]hexoxy]butyl]phenyl]-N-methylethenesulfonamide

Names & synonyms

SCHEMBL4808399RSVZTDKTUVPABQ-HCMPGTLISA-N(E)-2-{3-[4-({6-[(5R)-5-(2,2-Dimethvl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]hexyl}oxy)butyl]phenyl}-N-methylethenesulfonamide(E)-2-{3-[4-({6-[(5R)-5-(2,2-Dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]hexyl}oxy)butyl]phenyl}-N-methylethenesulfonamide

Database identifiers

PubChem CID
69199403

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
112 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
16
Heavy atoms
42

Related reactions

4 records

Compound notes

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