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Panamesine

Panamesine structure

CAS No:
139225-22-2
Formula:
C23H26N2O6
Chemical Name:
Panamesine
Synonyms:
2-Oxazolidinone,5-[[4-(1,3-benzodioxol-5-yl)-4-hydroxy-1-piperidinyl]methyl]-3-(4-methoxyphenyl)-,(5S)-;2-Oxazolidinone,5-[[4-(1,3-benzodioxol-5-yl)-4-hydroxy-1-piperidinyl]methyl]-3-(4-methoxyphenyl)-,(S)-;(5S)-5-[[4-(1,3-Benzodioxol-5-yl)-4-hydroxy-1-piperidinyl]methyl]-3-(4-methoxyphenyl)-2-oxazolidinone;Panamesine

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Panamesine Basic Attributes

Molecular Weight：

426.46

Exact Mass：

426.46

UNII：

023D9E916L

DSSTox ID：

DTXSID00160971

Characteristics

PSA：

80.70000

XLogP3：

2.73560

Density：

1.343±0.06 g/cm3

Melting Point：

165 °C @ Solvent: Ethanol, Dichloromethane

Boiling Point：

614.1±55.0 °C(Predicted)

Flash Point：

325.2ºC

Refractive Index：

1.621

Vapor Pressure：

6.17E-16mmHg at 25°C

PKA：

13.84±0.20

Drug Information

MeSH Entry Terms：

(5S)-5-((4-Hydroxy-4-(3,4-(methylenedioxy)phenyl)piperidino)methyl)-3-(p-methoxyphenyl)-2-oxazolidinone

Computed Properties

Molecular Weight:426.5
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:426.17908655
Monoisotopic Mass:426.17908655
Topological Polar Surface Area:80.7
Heavy Atom Count:31
Complexity:632
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Panamesine

Basic Attributes
Characteristics
Drug Information
Computed Properties

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