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Desfluoro EzetiMibe

Desfluoro EzetiMibe structure

CAS No:
302781-98-2
Formula:
C24H22FNO3
Chemical Name:
Desfluoro EzetiMibe
Synonyms:
Desfluoro EzetiMibe;(3R,4S)-3-[(3S)-3-(4-Fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-1-phenyl-2-azetidinone;1-Desfluoro EzetiMibe;EzetiMibe Desfluoro Analog;(3R,4S)-3-((S)-3-(4-fluorophenyl)-3-hydroxypropyl)-4-(4-hydroxyphenyl)-1-phenylazetidin-2-one;1-phenyl-3(R)-[3-(4-fluorophenyl) -3(S)-hydroxypropyl]-4(S)-(4-hydroxyphenyl)-2-azetidinone;2-Azetidinone, 3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-1-phenyl-, (3R,4S)-;Ezetimibe Desfluoroaniline Analog
Categories:
Active Pharmaceutical Ingredients > Other Chemical Drugs

Description

Desfluoro-ezetimibe is a desfluoro impurity of Ezetimibe. Ezetimibe is a potent, metabolically stable cholesterol absorption inhibitor. Ezetimibe is a Niemann-Pick C1-like1 (NPC1L1) inhibitor, and is a potent Nrf2 activator[1][2].

Desfluoro EzetiMibe Basic Attributes

Molecular Weight：

391.4347832

Exact Mass：

391.158386

DSSTox ID：

DTXSID00730350

Characteristics

PSA：

60.8

XLogP3：

3.20

Density：

1.3±0.1 g/cm3

Boiling Point：

642.8±55.0 °C at 760 mmHg

Flash Point：

342.6±31.5 °C

Refractive Index：

1.635

Desfluoro EzetiMibe Use and Manufacturing

An impurity of the cholesterol absorption inhibitor Ezetimibe (E975000).

Computed Properties

Molecular Weight:391.4
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:391.15837173
Monoisotopic Mass:391.15837173
Topological Polar Surface Area:60.8
Heavy Atom Count:29
Complexity:536
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 302781-98-2

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