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Chemical structure of RTIOXA-43

GC71296

RTIOXA-43

Also known as N-[2-[3-[[2-methoxy-5-[3-[methyl(pyridin-4-ylmethyl)carbamoyl]phenyl]phenyl]sulfonylamino]anilino]ethyl]-3-methylbenzamide

RTIOXA-43 is a orexin receptor agonist with EC50s of 24 nM and 24 nM for OX2 and OX1 receptors, respectively

ChemicalCAS2832067-72-6MW663.79FormulaC37H37N5O5S
CAS number
2832067-72-6
Molecular weight
663.79
Formula
C37H37N5O5S
Solubility
DMSO ： 100 mg/mL (150·65 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
WIANBLHLJZGLLG-UHFFFAOYSA-N
Catalogue number
GC71296
Brand
GLPBIO
Computed properties PubChem CID 166625259 · XLogP 5.2 · TPSA 138 Ų · H-bond donors 3
XLogP
5.2
TPSA
138 Ų
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
13
Heavy atoms
48

SMILES CC1=CC(=CC=C1)C(=O)NCCNC2=CC(=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)C4=CC(=CC=C4)C(=O)N(C)CC5=CC=NC=C5)OC

Computed descriptors from PubChem (CID 166625259), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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