 Home > Encyclopedia > 2-(4-aminophenyl)-3-[[benzyl(methyl)amino]methyl]-7-[(2,6-difluorophenyl)methyl]-5-(2-methylpropanoyl)thieno[2,3-b]pyridin-4-one

2-(4-aminophenyl)-3-[[benzyl(methyl)amino]methyl]-7-[(2,6-difluorophenyl)methyl]-5-(2-methylpropanoyl)thieno[2,3-b]pyridin-4-one

2-(4-aminophenyl)-3-[[benzyl(methyl)amino]methyl]-7-[(2,6-difluorophenyl)methyl]-5-(2-methylpropanoyl)thieno[2,3-b]pyridin-4-one structure

CAS No:
174072-26-5
Formula:
C33H31F2N3O2S
Chemical Name:
2-(4-aminophenyl)-3-[[benzyl(methyl)amino]methyl]-7-[(2,6-difluorophenyl)methyl]-5-(2-methylpropanoyl)thieno[2,3-b]pyridin-4-one

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2-(4-aminophenyl)-3-[[benzyl(methyl)amino]methyl]-7-[(2,6-difluorophenyl)methyl]-5-(2-methylpropanoyl)thieno[2,3-b]pyridin-4-one Basic Attributes

Molecular Weight：

571.68000

Exact Mass：

571.21050474

DSSTox ID：

DTXSID40468261

Characteristics

PSA：

96.57000

XLogP3：

7.69060

Density：

1.297g/cm3

Boiling Point：

724.649ºC

Flash Point：

392.054ºC

Refractive Index：

1.641

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:571.7
XLogP3:6.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:571.21050474
Monoisotopic Mass:571.21050474
Topological Polar Surface Area:94.9
Heavy Atom Count:41
Complexity:939
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-aminophenyl)-3-[[benzyl(methyl)amino]methyl]-7-[(2,6-difluorophenyl)methyl]-5-(2-methylpropanoyl)thieno[2,3-b]pyridin-4-one

Basic Attributes
Characteristics
Computed Properties

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