 Home > Encyclopedia > 4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile

4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile

4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile structure

CAS No:
114856-44-9
Formula:
C25H30ClN5O3
Chemical Name:
4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile
Synonyms:
Oberadilol [INN]; Oberadilol; UNII-7ZNX9ET039;

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4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile Basic Attributes

Molecular Weight：

483.99000

Exact Mass：

483.2037175

UNII：

7ZNX9ET039

DSSTox ID：

DTXSID2048745

Characteristics

PSA：

122.26000

XLogP3：

3.46718

Density：

1.28g/cm3

Refractive Index：

1.615

Computed Properties

Molecular Weight:484.0
XLogP3:3.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:483.2037175
Monoisotopic Mass:483.2037175
Topological Polar Surface Area:119
Heavy Atom Count:34
Complexity:759
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-chloro-2-[2-hydroxy-3-[[2-methyl-1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)anilino]propan-2-yl]amino]propoxy]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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