CAS: 103532-27-0; (2R,3S)-5-(2-(Dimethylamino)Ethyl)-2-(4-Methoxyphenyl)-4-Oxo-2,3,4,5-Tetrahydrobenzo[b][1,4]Thiazepin-3-Yl Acetate Hydrochloride

• 英文名称(2R,3S)-5-(2-(Dimethylamino)Ethyl)-2-(4-Methoxyphenyl)-4-Oxo-2,3,4,5-Tetrahydrobenzo[b][1,4]Thiazepin-3-Yl Acetate Hydrochloride
• 中文名称(2R-反式)-3-(乙酰氧基)-5-[2-(二甲基氨基)乙基]-2,3-二氢-2-(4-甲氧基苯基)-1,5-苯并硫氮杂卓-4(5H)-酮单盐酸盐
• IUPAC名称(2R,3S)-5-(2-(Dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate hydrochloride
• 其它别名1,5-Benzothiazepin-4(5H)-One, 3-(Acetyloxy)-5-[2-(Dimethylamino)Ethyl]-2,3-Dihydro-2-(4-Methoxyphenyl)-, Monohydrochloride, (2R-Trans)-; (+)-Trans-Diltiazem Hydrochloride; (2R-Trans)-3-(Acetyloxy)-5-[2-(Dimethylamino)Ethyl]-2,3-Dihydro-2-(4-Methoxyphenyl)-1,5-Benzothiazepin-4(5H)-One Monohydrochloride; (2R-Trans)-Diltiazem Hydrochloride; Diltiazem Impurity 1(Diltiazem Ep Impurity A); Diltiazem-Ep-Imp-A; (2R,3S)-5-(2-(Dimethylamino)Ethyl)-2-(4-Methoxyphenyl)-4-Oxo-2,3,4,5-Tetrahydrobenzo[b][1,4]Thiazepin-3-Yl Acetate Hydrochloride; Diltiazem Imp A
• CAS编号103532-27-0
• 分子式:C22H27ClN2O4S分子量:450.99
• 产品CID: 70060
• 产品分类原料药 → 循环系统用药 → 防治心绞痛药

• 相似结构搜索
• InChIKey: HDRXZJPWHTXQRI-MUCZFFFMSA-N
• InChI=1S/C22H26N2O4S.ClH/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3;/h5-12,20-21H,13-14H2,1-4H3;1H/t20-,21-;/m1./s1
• 计算化学: 氢键受体数6.0氢键供体数1.0可旋转键数7.0

物理性质

• PSA:84.38
• LogP:4.2355
• 储存条件-10 to -25°C

MSDS等安全信息

合成工艺路线路线简述

其他信息查阅

• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管