CAS号:1808714-73-9-EN6 - N-[4-fluoro-3-(prop-2-enamido)phenyl]-1-(2-fluorophenyl)-1H-pyrazole-4-carboxamide-科华智慧

1. 主信息

英文名:	N-[4-fluoro-3-(prop-2-enamido)phenyl]-1-(2-fluorophenyl)-1H-pyrazole-4-carboxamide
中文名:	EN6
CAS编号:	1808714-73-9
化学分子式：	C₁₉H₁₄F₂N₄O₂
化学分子量：	368.3 g/mol
SMILES：	C=CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CN(N=C2)C3=CC=CC=C3F)F
来源：	合成化合物
结构类型：	-
其它名称或标识：	autophagy activator EN6 en6 compound N-(3-acrylamido-4-fluorophenyl)-1-(2-fluorophenyl)-1H-pyrazole-4-carboxamide

2. 供应商与价格

供应商	包装规格	含量	价格(元)	环境要求	货期	说明
科华智慧	2mg	95%	320	-20°C	现货	-
科华智慧	5mg	95%	576	-20°C	现货	-
科华智慧	10mg	95%	960	-20°C	现货	-
科华智慧	50mg	95%	1920	-20°C	现货	-
科华智慧	100mg	95%	2880	-20°C	现货	-

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3. 结构

3.1 二维结构

3.2 三维结构

-1 -2 -3 41 43 0 0 0 0 0 0 0999 V2000 5.2153 2.4060 0.6733 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.0438 -2.3639 -0.1203 F 0 0 0 0 0 0 0 0 0 0 0 0 0.4184 -2.4667 0.3499 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5229 2.4720 -0.1518 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6691 0.1633 0.1559 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8338 -0.4877 0.2017 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0716 1.2476 0.6789 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5919 0.3753 -0.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5823 -0.4526 0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0253 0.1716 -0.1147 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 -0.8827 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1655 -0.9638 0.1194 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3722 -1.2148 0.3101 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7971 0.8654 0.7944 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2238 -0.0610 0.0165 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5349 -0.5298 -0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4183 -2.3354 0.1412 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7857 1.3101 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6321 -0.9610 -0.6575 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7878 -1.9013 -0.0431 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7295 -2.8042 0.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1530 1.3159 -0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9994 -0.9551 -0.9336 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7599 0.1832 -0.6668 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5293 1.7750 -0.2046 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8863 2.3836 -0.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0343 3.7111 -0.3707 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1116 -1.8375 -0.4751 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7526 0.5261 0.1661 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9621 0.9878 0.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0851 1.5684 1.2032 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6532 -3.0944 0.2187 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0995 -1.8768 -0.8882 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9281 -3.8719 0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7448 2.2024 0.0838 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4728 -1.8366 -1.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5137 -0.0536 -0.2223 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8245 0.1879 -0.8817 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7551 1.7359 -0.3649 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1942 4.3954 -0.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0260 4.1430 -0.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 20 1 0 0 0 0 3 13 2 0 0 0 0 4 25 2 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 29 1 0 0 0 0 7 14 2 0 0 0 0 8 16 1 0 0 0 0 8 25 1 0 0 0 0 8 37 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 18 1 0 0 0 0 10 19 2 0 0 0 0 11 28 1 0 0 0 0 12 15 2 0 0 0 0 12 17 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 20 2 0 0 0 0 17 21 2 0 0 0 0 17 32 1 0 0 0 0 18 22 2 0 0 0 0 19 23 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 34 1 0 0 0 0 22 24 1 0 0 0 0 22 35 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0

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4. 国际命名与标识

4.1 IUPAC Name

1-(2-fluorophenyl)-N-[4-fluoro-3-(prop-2-enoylamino)phenyl]pyrazole-4-carboxamide

4.2 InChl

InChI=1S/C19H14F2N4O2/c1-2-18(26)24-16-9-13(7-8-14(16)20)23-19(27)12-10-22-25(11-12)17-6-4-3-5-15(17)21/h2-11H,1H2,(H,23,27)(H,24,26)

4.3 InChlKey

SUSXQEYPNDORDQ-UHFFFAOYSA-N

4.4 Canonical SMILES

C=CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CN(N=C2)C3=CC=CC=C3F)F

4.5 lsomeric SMILES

4.6 SDF文件

补充中

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5. 波谱数据

5.1 ¹³C核磁共振谱(¹³C NMR)

5.2 ¹H核磁共振谱(¹H NMR)

5.3 质谱(MS)

补充中

5.4 红外光谱(IR)

补充中

5.5 紫外/可见光谱(UV/Vis)

补充中

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6. 相关药材

中文名称

英文名称

拉丁文名称

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7. 相关靶点

基因靶点

靶点位置

参考文献

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8. 相关疾病

疾病名称

疾病类型