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Ethyl (3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoate

Ethyl (3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoate structure

CAS No:
172336-32-2
Formula:
C27H28FNO4
Chemical Name:
Ethyl (3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoate
Synonyms:
6-Heptenoic acid,7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-,ethyl ester,(3R,5S)-;6-Heptenoic acid,7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-,ethyl ester,[S-(R*,S*)]-;Ethyl (3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoate
Categories:
Pharmaceutical Intermediates > Cardiovascular Agents

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Ethyl (3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoate Basic Attributes

Molecular Weight：

449.51400

Exact Mass：

449.51

EC Number：

605-634-7

Characteristics

PSA：

79.65000

XLogP3：

4.99660

Density：

1.271 g/cm3

Boiling Point：

670.412ºC at 760 mmHg

Flash Point：

359.252ºC

Refractive Index：

1.639

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:449.5
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:449.20023654
Monoisotopic Mass:449.20023654
Topological Polar Surface Area:79.6
Heavy Atom Count:33
Complexity:661
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl (3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoate

Basic Attributes
Characteristics
Computed Properties
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