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ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate

ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate structure

CAS No:
290299-60-4
Formula:
C15H18N2O3S
Chemical Name:
ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate
Synonyms:
MLS000779944;SMR000420110;4-(3-Cyano-6-ethyl-5-methyl-pyridin-2-ylsulfanyl)-3-oxo-butyric acid ethyl ester;CHEMBL1520264;BDBM51747;cid_1963384;HMS2809F04;ZINC2350520;STK747503;AKOS001721364;ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate;MCULE-4773740373;ST007010;SR-01000508441;SR-01000508441-1;ethyl 4-(3-cyano-6-ethyl-5-methyl(2-pyridylthio))-3-oxobutanoate;ethyl 4-[(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl]-3-oxobutanoate;4-[(3-cyano-6-ethyl-5-methyl-2-pyridinyl)thio]-3-oxobutanoic acid ethyl ester;4-[(3-cyano-6-ethyl-5-methyl-2-pyridyl)thio]-3-keto-butyric acid ethyl ester;ethyl 4-(3-cyano-6-ethyl-5-methyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate;290299-60-4

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ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate Basic Attributes

Molecular Weight：

306.4 g/mol

Exact Mass：

306.10381361 g/mol

Characteristics

PSA：

105 Å²

XLogP3：

2.43848

Melting Point：

83 - 84 °C

Water Solubility：

>46 [ug/mL]

Computed Properties

Molecular Weight:306.4
XLogP3:2.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:306.10381361
Monoisotopic Mass:306.10381361
Topological Polar Surface Area:105
Heavy Atom Count:21
Complexity:418
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate

Basic Attributes
Characteristics
Computed Properties
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