5-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene-N-methyl-4-thiazolidinone

HCID 130001

基本情報

標準SMILES
CN1CSC(=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C1=O
InChIKey
IXCMEASJCGKKQS-UHFFFAOYSA-N
分子式
C19H27NO2S
平均分子量
333.5 g/mol

名称と識別子

優先名称
5-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene-N-methyl-4-thiazolidinone
IUPAC
5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-3-methyl-1,3-thiazolidin-4-one

名称と別名

5-(3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene-N-methyl-4-thiazolidinoneRefChem:9131235-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-3-methyl-1,3-thiazolidin-4-one4-Thiazolidinone,5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-3-methyl-5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-3-methyl-4-thiazolidinone5-{[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylene}-3-methyl-4-thiazolidinoneorb1700075SCHEMBL8532780IXCMEASJCGKKQS-UHFFFAOYSA-N5-{[3,5-bis(1,1-dimethylethyl)-4hydroxyphenyl]methylene}-3-methyl-4-thiazolidinone

データベース識別子

PubChem CID
130001

物性

構造計算による物性

XLogP
5.4
極性表面積
65.8 Ų
水素結合供与体数
1
水素結合受容体数
3
回転可能結合数
3
重原子数
23

関連反応

8 件

関連ノート

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