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Chemical structure of WY 45233 succinate

GC14743

WY 45233 succinate

Also known as butanedioic acid;4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

serotonin and noradrenalin reuptake inhibitor

ChemicalCAS448904-47-0MW381.46FormulaC16H25NO2·C4H6O4
CAS number
448904-47-0
Molecular weight
381.46
Formula
C16H25NO2·C4H6O4
Solubility
＜19·07mg/ml in Water; ＜38·15mg/ml in DMSO
InChIKey
ORUUBRMVQCKYHB-UHFFFAOYSA-N
Catalogue number
GC14743
Brand
GLPBIO
Computed properties PubChem CID 9800068 · TPSA 118 Ų · H-bond donors 4 · H-bond acceptors 7
TPSA
118 Ų
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
27

SMILES CN(C)CC(C1=CC=C(C=C1)O)C2(CCCCC2)O.C(CC(=O)O)C(=O)O

Computed descriptors from PubChem (CID 9800068), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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