1-[(4-{[(2,4-Diaminopteridin-6-yl)methyl]methylamino}-5-bromo-3-chlorophenyl)carbonylamino]propane-1,3-dicarboxylic acid结构式
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常用名 | 1-[(4-{[(2,4-Diaminopteridin-6-yl)methyl]methylamino}-5-bromo-3-chlorophenyl)carbonylamino]propane-1,3-dicarboxylic acid | 英文名 | 1-[(4-{[(2,4-Diaminopteridin-6-yl)methyl]methylamino}-5-bromo-3-chlorophenyl)carbonylamino]propane-1,3-dicarboxylic acid |
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| CAS号 | 6914-12-1 | 分子量 | 567.78000 | |
| 密度 | 1.753g/cm3 | 沸点 | N/A | |
| 分子式 | C20H20BrClN8O5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | Bromochloromethotrexate |
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| 英文别名 | 更多 |
| 密度 | 1.753g/cm3 |
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| 分子式 | C20H20BrClN8O5 |
| 分子量 | 567.78000 |
| 精确质量 | 566.04300 |
| PSA | 210.54000 |
| LogP | 3.23760 |
| InChIKey | AKDWTVCYSZSYQZ-LBPRGKRZSA-N |
| SMILES | CN(Cc1cnc2nc(N)nc(N)c2n1)c1c(Cl)cc(C(=O)NC(CCC(=O)O)C(=O)O)cc1Br |
| 折射率 | 1.747 |
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1-[(4-{[(2,4-Di... 6914-12-1 |
| 文献:Angier; Curran Journal of the American Chemical Society, 1959 , vol. 81, p. 2814,2816 |
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1-[(4-{[(2,4-Di... 6914-12-1 |
| 文献:Angier; Curran Journal of the American Chemical Society, 1959 , vol. 81, p. 2814,2816 |
| 上游产品 2 | |
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| 下游产品 0 | |
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实验名称:NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
来源:DTP/NCI
靶标:N/A
External Id:MCF7_OneDose
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实验名称:NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
来源:DTP/NCI
靶标:N/A
External Id:IGROV1_OneDose
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| N-{3-Brom-5-chlor-4-[(2,4-diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoyl}-L-glutaminsaeure |
| 3'-Bromomethotrexate |
| L-Glutamic acid,N-(3-bromo-4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl) |
| N-{3-Brom-4-[(2,4-diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoyl}-L-glutaminsaeure |
| N-{3-bromo-4-[(2,4-diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoyl}-L-glutamic acid |
| Glutamic acid,N-[3-bromo-4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-,L |
| N-{3-bromo-5-chloro-4-[(2,4-diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoyl}-L-glutamic acid |
| Monobromomethotrexate |