2-(4-{2-[2-(4-Bromophenyl)-5-methyloxazol-4-yl]ethoxy}phenoxy)-2-methylpropionic acid ethyl ester

HCID 11027342

基本情報

標準SMILES
CCOC(=O)C(C)(C)Oc1ccc(OCCc2nc(-c3ccc(Br)cc3)oc2C)cc1
InChIKey
SMVLDNUJSZVHQF-UHFFFAOYSA-N
分子式
C24H26BrNO5
平均分子量
488.4 g/mol

名称と識別子

優先名称
2-(4-{2-[2-(4-Bromophenyl)-5-methyloxazol-4-yl]ethoxy}phenoxy)-2-methylpropionic acid ethyl ester
IUPAC
ethyl 2-[4-[2-[2-(4-bromophenyl)-5-methyl-1,3-oxazol-4-yl]ethoxy]phenoxy]-2-methylpropanoate

名称と別名

2-(4-(2-[2-(4-Bromophenyl)-5-methyloxazol-4-yl]ethoxy)phenoxy)-2-methyl propionic acid ethyl ester2-(4-{2-[2-(4-bromo-phenyl)-5-methyl-oxazol-4-yl]-ethoxy)-phenoxy)-2-methyl-propionic acid ethyl ester2-(4-{2-[2-(4-bromo-phenyl)-5-methyl-oxazol-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester2-(4-{2-[2-(4-bromophenyl)-5-methyloxazol-4-yl]ethoxy}phenoxy)-2-methyl propionic acid ethyl esterSCHEMBL5099380SMVLDNUJSZVHQF-UHFFFAOYSA-N2-(4-{2-[2-(4-bromo-phenyl)-5-methyloxazol-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester2-(4-{2-[2-(4-bromophenyl)-5-methyl-oxazol-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester2-(4-{2-[2-(4-bromophenyl)-5-methyloxazol-4-yl]ethoxy}-phenoxy)-2-methylpropionic acid ethyl ester2-(4-{2-[2-(4-bromophenyl)-5-methyloxazol-4-yl]ethoxy}phenoxy)-2-methyl-propionic acid ethyl ester2-(4-{2-[2-(4-bromophenyl)-5-methyloxazol-4-yl]ethoxy}phenoxy)-2-methylpropionic acid ethyl ester

データベース識別子

PubChem CID
11027342

物性

構造計算による物性

XLogP
5.9
極性表面積
70.8 Ų
水素結合供与体数
0
水素結合受容体数
6
回転可能結合数
10
重原子数
31

関連反応

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