LX-4211 | 1018899-04-1

中文名称:LX-4211
英文名称:Sotagliflozin
CAS No.:1018899-04-1
分子式:C21H25ClO5S 分子量:424.9382
武汉鑫伟烨化工有限公司
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名称和标识符
  • InChIKey:QKDRXGFQVGOQKS-CRSSMBPESA-N
  • Inchi:1S/C21H25ClO5S/c1-3-26-15-7-4-12(5-8-15)10-14-11-13(6-9-16(14)22)20-18(24)17(23)19(25)21(27-20)28-2/h4-9,11,17-21,23-25H,3,10H2,1-2H3/t17-,18-,19+,20+,21-/m1/s1
  • SMILES:ClC1C([H])=C([H])C(=C([H])C=1C([H])([H])C1C([H])=C([H])C(=C([H])C=1[H])OC([H])([H])C([H])([H])[H])[C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@]([H])(O1)SC([H])([H])[H])O[H])O[H])O[H]
中文别名
  • (2S,3R,4R,5S,6R)-2-(4-氯-3-(4-乙氧基苄基)苯基)-6-(甲基硫代)四氢-2H-吡喃-3,4,5-三醇
  • (2S,3R,4R,5S,6R)-2-(4-氯-3-(4-乙氧基苄基)苯基)-6-(甲硫基)四氢-2H-吡喃-3,4,5 - 三醇
  • LX4211 抑制剂
  • 苯基磺酰氨甲基三氟硼酸钾
  • 索格列净
  • 糖4211
  • (2S,3R,4R,5S,6R)-2-(4-氯-3-(4-乙氧基苄基)苯基)-6-(
  • 2抑制剂
  • LX4211, 一种SGLT1
  • LX-4211
英文别名
  • (2S,3R,4R,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-methylsulfanyloxane-3,4,5-triol
  • LP 802034
  • LX4211
  • Sotagliflozin (LX4211)
  • (2S,3R,4R,5S,6R)-2-(4-chloro-3-(4-ethoxybenzyl)phenyl)-6-(methylthio)tetrahydro-2H-pyran-3,4,5-triol
  • (2S,3R,4R,5S,6R)-2-[4-chloro-3-(4-ethoxy-benzyl)-phenyl]-6-methylsulfanyl-tetrahydro-pyran-3,4,5-triol
  • CS-1069
  • LP-802034
  • Sotagliflozin
  • UNII-6B4ZBS263Y
  • LX-4211
  • SOTA-009
  • (5S)-Methyl 5-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-1-thio-beta-L-xylopyranoside
  • LX421
  • EOS-61381
  • LX4211 - L10525
  • LX-4211 (sotagliflozin)
  • Zabofloxacin Hydrochloride
  • 6B4ZBS263Y
  • beta-l-Xylopyranoside, methyl 5-C-(4-chloro-3-((4-ethoxyphenyl)methyl)phenyl)-1-thio-, (5S)-
  • b-L-Xylopyranoside, methyl 5-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-1-thio-, (5S)-
  • b-L-Xylopyranoside, methyl 5-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-1-thio-, (5S)-
  • Sotaglifloz
计算特性
  • 精确分子量:424.11100
  • 氢键供体数量:3
  • 氢键受体数量:6
  • 可旋转化学键数量:6
  • 重原子数量:28
  • 复杂度:476
  • 拓扑分子极性表面积:104
实验特性
  • LogP:3.17260
  • PSA:104.45000
  • 沸点:607.9±55.0°C at 760 mmHg
  • 溶解度:几乎不溶 (0.014 g/L) (25 ºC),
  • 密度:1.37±0.1 g/cm3 (20 ºC 760 Torr),