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Biphenyl indanone A

Biphenyl indanone A structure

CAS No:
866823-73-6
Formula:
C30H30O4
Chemical Name:
Biphenyl indanone A
Synonyms:
[1,1′-Biphenyl]-4-carboxylic acid,3′-[[(2-cyclopentyl-2,3-dihydro-6,7-dimethyl-1-oxo-1H-inden-5-yl)oxy]methyl]-;3′-[[(2-Cyclopentyl-2,3-dihydro-6,7-dimethyl-1-oxo-1H-inden-5-yl)oxy]methyl][1,1′-biphenyl]-4-carboxylic acid;3′-[[(2-Cyclopentyl-6,7-dimethyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy]methyl]biphenyl-4-carboxylic acid;MRLSD 230;Biphenyl indanone A;3′-(((2-Cyclopentyl-6,7-dimethyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)methyl)-[1,1′-biphenyl]-4-carboxylic acid

Description

Biphenylindanone A (BINA) is a selective human mGluR2 (hmGluR2) potentiator for the treatment of many neurological disorders[1].

Biphenyl indanone A Basic Attributes

Molecular Weight：

454.5568

Exact Mass：

454.56

EC Number：

-0

DSSTox ID：

DTXSID90432098

Characteristics

PSA：

63.6

XLogP3：

8.27

Appearance：

white to tan

Density：

1.2±0.1 g/cm3

Melting Point：

238-241 °C

Boiling Point：

676.9±55.0 °C at 760 mmHg

Flash Point：

225.8±25.0 °C

Refractive Index：

1.627

Water Solubility：

DMSO: ≥18mg/mL

Storage Conditions：

Desiccate at RT

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

Drug Information

MeSH Entry Terms：

3'-(((2-cyclopentyl-6,7-dimethyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)methyl)biphenyl-4-carboxylic acid

Biphenyl indanone A Use and Manufacturing

Biphenylindanone A is an orally active metabotropic glutamate subtype 2 receptor positive allosteric modulator.

Computed Properties

Molecular Weight:454.6
XLogP3:7.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:454.21440943
Monoisotopic Mass:454.21440943
Topological Polar Surface Area:63.6
Heavy Atom Count:34
Complexity:719
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Biphenyl indanone A

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Biphenyl indanone A

SDS

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