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2-Methyl-N-{4-[(5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)car bonyl]phenyl}benzamide

2-Methyl-N-{4-[(5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)car bonyl]phenyl}benzamide structure

CAS No:
137976-61-5
Formula:
C25H22N2O3
Chemical Name:
2-Methyl-N-{4-[(5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)car bonyl]phenyl}benzamide
Synonyms:
1,3-Dimethyl-5-oxo-cyclohexancarbonitril; 2-methyl-4'-[(5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl]benzanilide; 1.3-Dimethyl-1-cyan-cyclohexanon-(5); 1,3-dimethyl-5-oxo-cyclohexanecarbonitrile; 5-Oxo-1.3-dimethyl-cyclohexan-carbonsaeure-(1)-nitril; 2-methyl-4'-(5-oxo-2,3,4,5-tetrahydro-1H-1-benzoazepine-1-carbonyl)benzanilide; 5-oxo-1-[4-(2-methylbenzoylamino)benzoyl]-2,3,4,5-tetrahydro-1H-benzazepine;Expand

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2-Methyl-N-{4-[(5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)car bonyl]phenyl}benzamide Basic Attributes

Molecular Weight：

398.45400

Exact Mass：

398.16304257

Characteristics

PSA：

66.48000

XLogP3：

5.00860

Density：

1.27g/cm3

Boiling Point：

553.103ºC

Flash Point：

288.307ºC

Computed Properties

Molecular Weight:398.5
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:398.16304257
Monoisotopic Mass:398.16304257
Topological Polar Surface Area:66.5
Heavy Atom Count:30
Complexity:640
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Methyl-N-{4-[(5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)car bonyl]phenyl}benzamide

Basic Attributes
Characteristics
Computed Properties

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