S-[5-[(4E)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(2-chloroanilino)ethanethioate

S-[5-[(4E)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(2-chloroanilino)ethanethioate 基本信息
CAS号 127227-39-8 分子式 C23H17ClN6O2S2
分子量 509.00300 精确质量  508.05400
PSA  156.88000 LogP  4.78330

基本信息 展开↓

CAS号:
127227-39-8
3D弹球模型:
立即前往扯扯看
分子式:
C23H17ClN6O2S2
分子量:
509.00300
英文名称:
S-[5-[(4E)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(2-chloroanilino)ethanethioate
英文别名:
S-[5-[(4E)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(2-chloroanilino)ethanethioate;
Ethanethioic acid,2-[(2-chlorophenyl)amino]-,S-[5-[4,5-dihydro-4-(1H-indol-3-ylmethylene)-2-methyl-5-oxo-1H-imidazol-1-yl]-1,3,4-thiadiazol-2-yl]ester
精确分子量/精确质量:
508.05400
极性分子表面积/PSA:
156.88000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: SRLWWZPMLRROTO-UHFFFAOYSA-N

物化性质展开↓

密度:
1.56g/cm3
沸点:
769.5ºC at 760mmHg
闪点:
419.2ºC
折射率:
1.779
蒸汽压:
1.34E-23mmHg at 25°C

合成路线查看所有的合成路线

  • 127227-45-6

    127227-45-6

  • +

  • 127227-36-5

    127227-36-5

  • ~58%

  • 127227-39-8

    S-[5-[(4E)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(2-chloroanilino)ethanethioate

  • 54753-57-0

    4-(1'H-indol-3'-ylmethylene)-2-methyl-5(4H)oxazolone

  • 127227-39-8

    S-[5-[(4E)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(2-chloroanilino)ethanethioate

  • 487-89-8

    3-吲哚甲醛

  • 127227-39-8

    S-[5-[(4E)-4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(2-chloroanilino)ethanethioate

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  • 487-89-8

    3-吲哚甲醛

  • 54753-57-0

    4-(1'H-indol-3'-ylmethylene)-2-methyl-5(4H)oxazolone

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