Pinokalant

Category	SARS-CoV
CAS	149759-26-2
Description	Pinokalant is a broad-spectrum and non-selectivecation channel inhibitor. Pinokalant significantly reduces cortical infarct volume. Pinokalant o improves the Metabolic and electrophysiologic status of the ischemic penumbra. Pinokalant reduces lesion size on magnetic resonance images in the acute phase following middle cerebral artery occlusion in rats. Pinokalant has the potential for the research of stroke. Pinokalant also shows anti-SARS-CoV-2 activity.

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Synonyms	1-Isoquinolineacetamide, 3,4-dihydro-6,7-dimethoxy-α-phenyl-N,N-bis[2-(2,3,4-trimethoxyphenyl)ethyl]-; 1-Isoquinolineacetamide, 3,4-dihydro-6,7-dimethoxy-α-phenyl-N,N-bis[2-(2,3,4-trimethoxyphenyl)ethyl]-, (±)-; 3,4-Dihydro-6,7-dimethoxy-α-phenyl-N,N-bis[2-(2,3,4-trimethoxyphenyl)ethyl]-1-isoquinolineacetamide; LOE 908; LOE-908; LOE908
IUPAC Name	2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-phenyl-N,N-bis[2-(2,3,4-trimethoxyphenyl)ethyl]acetamide
Molecular Weight	712.83
Molecular Formula	C41H48N2O9
Canonical SMILES	COC1=C(C(=C(C=C1)CCN(CCC2=C(C(=C(C=C2)OC)OC)OC)C(=O)C(C3=CC=CC=C3)C4=NCCC5=CC(=C(C=C54)OC)OC)OC)OC
InChI	InChI=1S/C41H48N2O9/c1-45-31-16-14-27(37(49-5)39(31)51-7)19-22-43(23-20-28-15-17-32(46-2)40(52-8)38(28)50-6)41(44)35(26-12-10-9-11-13-26)36-30-25-34(48-4)33(47-3)24-29(30)18-21-42-36/h9-17,24-25,35H,18-23H2,1-8H3
InChIKey	PYWYBTRACMRUQV-UHFFFAOYSA-N
Boiling Point	803.7±65.0°C at 760 mmHg
Purity	≥95%
Density	1.17±0.1 g/cm3
Solubility	Soluble in DMSO
Appearance	Solid powder
Storage	Store at -20°C
Complexity	1060
Exact Mass	712.33598111
In Vivo	Pinokalant significantly reduces cortical infarct volume from 33.8 mm3 to 24.5 mm3.
PSA	106.51000
Target	TRP Channel; SARS-CoV
XLogP3-AA	6.6