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(3R,4S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyridin-1-yl)-3,4-dihydrochromene-6-carbonitrile

(3R,4S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyridin-1-yl)-3,4-dihydrochromene-6-carbonitrile structure

CAS No:
123595-75-5
Formula:
C17H16N2O3
Chemical Name:
(3R,4S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyridin-1-yl)-3,4-dihydrochromene-6-carbonitrile
Synonyms:
EMD 56431;EMD-56431;Emd 56431;EMD-56431;EMD 56 431;SCHEMBL9142302;129729-66-4;(3R,4S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyridin-1-yl)-3,4-dihydrochromene-6-carbonitrile;123595-75-5;2H-1-Benzopyran-6-carbonitrile, 3,4-dihydro-3-hydroxy-2,2-dimethyl-4-(2-oxo-1(2H)-pyridinyl)-, trans-(+-)-

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(3R,4S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyridin-1-yl)-3,4-dihydrochromene-6-carbonitrile Basic Attributes

Molecular Weight：

296.32 g/mol

Exact Mass：

296.11609238 g/mol

Characteristics

PSA：

73.6 Å²

Drug Information

MeSH Entry Terms：

EMD 56431

Computed Properties

Molecular Weight:296.32
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:296.11609238
Monoisotopic Mass:296.11609238
Topological Polar Surface Area:73.6
Heavy Atom Count:22
Complexity:572
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (3R,4S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyridin-1-yl)-3,4-dihydrochromene-6-carbonitrile

Basic Attributes
Characteristics
Drug Information
Computed Properties

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