HCID59559369

tert-Butyl 4-{1H-pyrrolo[2,3-c]pyridin-3-yl}-1,2,3,6-tetrahydropyridine-1-carboxylate

tert-butyl 4-(1H-pyrrolo[2,3-c]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate

C17H21N3O2299.37 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)OC(=O)N1CC=C(c2c[nH]c3cnccc23)CC1
InChIKey: GKRGWXKWVGPENS-UHFFFAOYSA-N
分子式: C17H21N3O2
平均分子量: 299.37 g/mol
单同位素质量: 299.16337692

COMPUTED

结构计算性质

已同步

XLogP: 2
极性表面积: 58.2 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 3
重原子: 22
形式电荷: 0
复杂度: 455

ALIASES

名称与别名

共 7 条

SCHEMBL12326386SCHEMBL31001707GKRGWXKWVGPENS-UHFFFAOYSA-NDB-193624tert-Butyl 4-{1H-pyrrolo[2,3-c]pyridin-3-yl}-1,2,3,6-tetrahydropyridine-1-carboxylate3,6-Dihydro-4-(1h-pyrrolo[2,3-c]pyridin-3-yl)-1(2h)-pyridinecarboxylic acid 1,1-dimethylethyl ester921196-57-8

REACTIONS

参与反应

2 条

uspto-grants-2016_01 · 10.6084/m9.figshare.5104873.v1 · US09227967B2

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uspto-grants-2015_10 · 10.6084/m9.figshare.5104873.v1 · US09150574B2

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