反应SMILES:O=C1NC(=O)C(c2cn3c4c(cccc24)CCC3)=C1c1c[nH]c2ccccc12
HCID9969209

3-(5,6-Dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(1H-indol-3-yl)-1H-pyrrole-2,5-dione

3-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)-4-(1H-indol-3-yl)pyrrole-2,5-dione

C23H17N3O2367.4 g/mol

IDENTITY

结构与身份

标准SMILES
O=C1NC(=O)C(c2cn3c4c(cccc24)CCC3)=C1c1c[nH]c2ccccc12
InChIKey
KHOMTMSVRMPSGP-UHFFFAOYSA-N
分子式
C23H17N3O2
平均分子量
367.4 g/mol
单同位素质量
367.13207679

COMPUTED

结构计算性质

已同步
XLogP
3.1
极性表面积
66.9 Ų
氢键供体
2
氢键受体
2
可旋转键
2
重原子
28
形式电荷
0
复杂度
731

ALIASES

名称与别名

共 21 条
345261-20-33-(5,6-Dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(1H-indol-3-yl)-1H-pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(1H-indol-3-yl)pyrrole-2,5-dione3-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)-4-(1H-indol-3-yl)pyrrole-2,5-dione1H-Pyrrole-2,5-dione, 3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(1H-indol-3-yl)-SCHEMBL224940KHOMTMSVRMPSGP-UHFFFAOYSA-NCS-M1639MFCD16876157AKOS022182818CS-14425F4459603-(5,6-dihydro-4H-pyrrolo[3,2,1-ij] quinolin-1-yl)-4-(1H-indol-3-yl)pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4(1H-indol-3-yl) pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4(1H-indol-3-yl)pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(1H-indol-3-yl) pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1yl)-4(1H-indol-3-yl) pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1yl)-4(1H-indol-3-yl)pyrrole-2,5-dione3-(5,6-dihydro-4H-pyrrolo [3,2,1 -ij] quinolin-1-yl)-4-(1H-indo1-3-yl) pyrrole-2, 5-dione3-(5,6-dihydro-4H-pyrrolo [3,2,1-ij] quinolin-1-yl)-4-(1H-indol-3-yl) pyrrole-2, 5-dione

REACTIONS

参与反应

22
HRID63551

uspto-grants-2016_09

作为反应物
HRID 63551 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09447088B2

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HRID63552

uspto-grants-2016_09

作为反应物
HRID 63552 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09447088B2

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HRID63570

uspto-grants-2016_09

作为反应物
HRID 63570 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09447088B2

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HRID146222

Training data from https://doi.org/10.1039/C8SC04228D (9/10)

作为反应物
HRID 146222 方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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HRID388323

uspto-grants-2013_02

作为反应物
HRID 388323 方程式

uspto-grants-2013_02 · 10.6084/m9.figshare.5104873.v1 · US08377927B2

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HRID388324

uspto-grants-2013_02

作为反应物
HRID 388324 方程式

uspto-grants-2013_02 · 10.6084/m9.figshare.5104873.v1 · US08377927B2

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HRID388342

uspto-grants-2013_02

作为反应物
HRID 388342 方程式

uspto-grants-2013_02 · 10.6084/m9.figshare.5104873.v1 · US08377927B2

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HRID405870

uspto-grants-2014_06

作为反应物
HRID 405870 方程式

uspto-grants-2014_06 · 10.6084/m9.figshare.5104873.v1 · US08754078B2

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