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Pafenolol

Pafenolol structure

CAS No:
75949-61-0
Formula:
C18H31N3O3
Chemical Name:
Pafenolol
Synonyms:
Urea,N-[2-[4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]ethyl]-N′-(1-methylethyl)-;Urea,N-[2-[4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]ethyl]-N′-(1-methylethyl)-,(±)-;N-[2-[4-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]ethyl]-N′-(1-methylethyl)urea;Pafenolol;83242-76-6
Categories:
Organic Chemistry > Amides

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Pafenolol Basic Attributes

Molecular Weight：

337.45700

Exact Mass：

337.46

UNII：

QW8T7NK8X6|E6X8CBK4RR

Characteristics

PSA：

86.11000

XLogP3：

2.66060

Density：

1.064g/cm3

Boiling Point：

551.3ºC

Flash Point：

287.2ºC

Refractive Index：

1.52

Drug Information

MeSH Entry Terms：

pafenolol

Computed Properties

Molecular Weight:337.5
XLogP3:2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:10
Exact Mass:337.23654186
Monoisotopic Mass:337.23654186
Topological Polar Surface Area:82.6
Heavy Atom Count:24
Complexity:342
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes