(1R,3S)-1-benzo[1,3]dioxol-5-yl-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-β-carboline-3-carboxylic acid methyl ester结构式
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常用名 | (1R,3S)-1-benzo[1,3]dioxol-5-yl-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-β-carboline-3-carboxylic acid methyl ester | 英文名 | (1R,3S)-1-benzo[1,3]dioxol-5-yl-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-β-carboline-3-carboxylic acid methyl ester |
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| CAS号 | 629652-44-4 | 分子量 | 426.85000 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C22H19ClN2O5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | (1R,3S)-1-benzo[1,3]dioxol-5-yl-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-β-carboline-3-carboxylic acid methyl ester |
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| 分子式 | C22H19ClN2O5 |
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| 分子量 | 426.85000 |
| 精确质量 | 426.09800 |
| PSA | 80.86000 |
| LogP | 3.08900 |
| InChIKey | JUKHNCNDFOAFLT-HRAATJIYSA-N |
| SMILES | COC(=O)C1Cc2c([nH]c3ccccc23)C(c2ccc3c(c2)OCO3)N1C(=O)CCl |
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(1R,3S)-1-benzo... 629652-44-4 |
| 文献:Daugan, Alain; Grondin, Pascal; Ruault, Cecile; Le Monnier de Gouville, Anne-Charlotte; Coste, Herve; Linget, Jean Michel; Kirilovsky, Jorge; Hyafil, Francois; Labaudinieret, Richard Journal of Medicinal Chemistry, 2003 , vol. 46, # 21 p. 4533 - 4542 |