Molecules/3-[4-[6-[[2-Hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]butyl]benzenesulfonamide
3-[4-[6-[[2-Hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]butyl]benzenesulfonamide
3-[4-[6-[[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]butyl]benzenesulfonamide
Molecular Identity
3-[4-[6-[[2-Hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]butyl]benzenesulfonamide
3-[4-[6-[[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]butyl]benzenesulfonamide
PubChem CID: 11378094
2D Structure
Properties
C25H38N2O6S
Molecular Formula
494.60
Molecular Weight
g/mol
494.2451
Exact Mass
Da
2.5
XLogP
Drug-like (Lipinski: < 5)
150
TPSA
May have limited oral absorption
5
H-Bond Donors
8
H-Bond Acceptors
629
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=CC(=C1)S(=O)(=O)N)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)OIsomeric SMILES
SMILES: C1=CC(=CC(=C1)S(=O)(=O)N)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)OSynonyms(4)
SCHEMBL233856SCHEMBL29798811GW597901XL021738
Data from PubChem (NCBI)
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Molecular Structure
3-[4-[6-[[2-Hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]butyl]benzenesulfonamide
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Drug Network
Trials and conditions connected to 3-[4-[6-[[2-Hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]butyl]benzenesulfonamide
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