5-[(4-nitroanilino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

5-[(4-nitroanilino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione 基本信息
CAS号 141177-54-0 分子式 C31H24N6O5S2
分子量 624.68900 精确质量  624.12500
PSA  188.20000 LogP  6.17230

基本信息 展开↓

CAS号:
141177-54-0
3D弹球模型:
立即前往扯扯看
分子式:
C31H24N6O5S2
分子量:
624.68900
英文名称:
5-[(4-nitroanilino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
英文别名:
5-[(4-nitroanilino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione;
10H-Phenothiazine,10-[[[tetrahydro-5-[[(4-nitrophenyl)amino]methyl]-4,6-dioxo-3-phenyl-2-thioxo-1(2H)-pyrimidinyl]amino]acetyl]-(9CI);
10H-Phenothiazine,10-(((tetrahydro-5-(((4-nitrophenyl)amino)methyl)-4,6-dioxo-3-phenyl-2-thioxo-1(2H)-pyrimidinyl)amino)acetyl);
4,6(1H,5H)-Pyrimidinedione,dihydro-5-[[(4-nitrophenyl)amino]methyl]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo
精确分子量/精确质量:
624.12500
极性分子表面积/PSA:
188.20000
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: KVDSUPIDKHNCPR-UHFFFAOYSA-N

物化性质展开↓

密度:
1.56g/cm3
沸点:
854.7ºC at 760 mmHg
闪点:
470.7ºC
折射率:
1.796
蒸汽压:
1.56E-29mmHg at 25°C

合成路线查看所有的合成路线

  • 50-00-0

    甲醛

  • +

  • 100-01-6

    4-硝基苯胺

  • +

  • 141177-47-1

    3-aryl-1-(10-phenothiazine acetyl amino)-2,3-dihydro-2-thioxo-4,6-(1H,5H)pyrimidinedione

  • ~65%

  • 141177-54-0

    5-[(4-nitroanilino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

  • 103-72-0

    硫代异氰酸苯酯

  • 141177-54-0

    5-[(4-nitroanilino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

  • 54012-74-7

    2-hydrazinyl-1-phenothiazin-10-ylethanone

  • 141177-54-0

    5-[(4-nitroanilino)methyl]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

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  • 50-00-0

    甲醛

  • 100-01-6

    4-硝基苯胺

  • 141177-47-1

    3-aryl-1-(10-phenothiazine acetyl amino)-2,3-dihydro-2-thioxo-4,6-(1H,5H)pyrimidinedione

  • 58914-88-8

    N-10-acetyl amino phenothiazyl-N-phenyl thiourea

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    2-hydrazinyl-1-phenothiazin-10-ylethanone

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