HCID9549225

(2S)-3-(1-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-indol-5-yl)-2-ethoxypropanoic acid

(2S)-3-[1-[[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]indol-5-yl]-2-ethoxypropanoic acid

C24H23ClN2O4438.9 g/mol

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IDENTITY

结构与身份

标准SMILES: CCO[C@@H](Cc1ccc2c(ccn2Cc2nc(-c3ccccc3Cl)oc2C)c1)C(=O)O
InChIKey: PAWOPJKHTZCKMT-QFIPXVFZSA-N
分子式: C24H23ClN2O4
平均分子量: 438.9 g/mol
单同位素质量: 438.1346349

COMPUTED

结构计算性质

已同步

XLogP: 4.8
极性表面积: 77.5 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 8
重原子: 31
形式电荷: 0
复杂度: 608

ALIASES

名称与别名

共 11 条

(2s)-3-(1-{[2-(2-Chlorophenyl)-5-Methyl-1,3-Oxazol-4-Yl]methyl}-1h-Indol-5-Yl)-2-Ethoxypropanoic Acid(2S)-3-(1-((2-(2-CHLOROPHENYL)-5-METHYL-1,3-OXAZOL-4-YL)METHYL)-1H-INDOL-5-YL)-2-ETHOXYPROPANOIC ACIDRefChem:3985072gtkSCHEMBL5780875PAWOPJKHTZCKMT-QFIPXVFZSA-NDB06908PD005792NS00069631Q27095812(S)-3-{1-[2-(2-Chloro-phenyl)-5-methyl-oxazol-4-ylmethyl]-1H-indol-5-yl}-2-ethoxy-propionic Acid

REACTIONS