HCID67263524

2-(7-amino-8-methoxy-1,2,4,5-tetrahydro-benzo[d]azepin-3-yl)-N,N-dimethylacetamide

2-(8-amino-7-methoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-N,N-dimethylacetamide

C15H23N3O2277.36 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1cc2c(cc1N)CCN(CC(=O)N(C)C)CC2
InChIKey: VNIPDDZWNNCUIT-UHFFFAOYSA-N
分子式: C15H23N3O2
平均分子量: 277.36 g/mol
单同位素质量: 277.17902698

COMPUTED

结构计算性质

已同步

XLogP: 1.1
极性表面积: 58.8 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 3
重原子: 20
形式电荷: 0
复杂度: 335

ALIASES

名称与别名

共 5 条

SCHEMBL2060677VNIPDDZWNNCUIT-UHFFFAOYSA-N2-(7-Amino-8-methoxy-1,2,4,5-tetrahydro-benzo[d]azepin-3-yl)-N,N-dimethyl-acetamide2-(7-amino-8-methoxy-1,2,4,5-tetrahydro-benzo[d]azepin-3-yl)-N,N-dimethylacetamide2-(7-amino-8-methoxy-1,2,4,5-tetrahydrobenzo[d]azepin-3-yl)-N,N-dimethylacetamide

REACTIONS

参与反应

48 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-2013_10 · 10.6084/m9.figshare.5104873.v1 · US08552186B2

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uspto-grants-2013_10 · 10.6084/m9.figshare.5104873.v1 · US08552186B2

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uspto-grants-2013_10 · 10.6084/m9.figshare.5104873.v1 · US08552186B2

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