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Draquinolol

Draquinolol structure

CAS No:
67793-71-9
Formula:
C24H30N2O4
Chemical Name:
Draquinolol
Synonyms:
1(2H)-Isoquinolinone,3-[4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]phenyl]-7-methoxy-2-methyl-;3-[4-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]phenyl]-7-methoxy-2-methyl-1(2H)-isoquinolinone;HI 42;H-I 42BS;Draquinolol;126522-41-6
Categories:
Organic Chemistry > Amides

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Draquinolol Basic Attributes

Molecular Weight：

410.514

Exact Mass：

410.51

Characteristics

PSA：

XLogP3：

3.73280

Density：

1.163g/cm3

Boiling Point：

610.715ºC at 760 mmHg

Flash Point：

323.149ºC

Refractive Index：

1.577

Drug Information

MeSH Entry Terms：

3-(4-(2-hydroxy-3-((1,1-dimethylethyl)amino)propoxy)phenyl)-7-methoxy-2-methyl-1(2H)-isoquinolinone

Computed Properties

Molecular Weight:410.5
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:410.22055744
Monoisotopic Mass:410.22055744
Topological Polar Surface Area:71
Heavy Atom Count:30
Complexity:607
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes