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Chemical structure of ACT 335827

GC16336

ACT 335827

Also known as (2R)-2-[(1S)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenyl-N-propan-2-ylacetamide

Orexin receptor 1 antagonist,potent and selective

ChemicalCAS1354039-86-3MW518.64FormulaC31H38N2O5
CAS number
1354039-86-3
Molecular weight
518.64
Formula
C31H38N2O5
Solubility
＜51·86mg/ml in DMSO; ＜51·86mg/ml in ethanol
InChIKey
HXHOBPVRRPCTLG-SETSBSEESA-N
Catalogue number
GC16336
Brand
GLPBIO
Computed properties PubChem CID 54765113 · XLogP 5.5 · TPSA 69.3 Ų · H-bond donors 1
XLogP
5.5
TPSA
69.3 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
38

SMILES CC(C)NC(=O)[C@@H](C1=CC=CC=C1)N2CCC3=CC(=C(C=C3[C@@H]2CC4=CC(=C(C=C4)OC)OC)OC)OC

Computed descriptors from PubChem (CID 54765113), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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