uspto-grants-2015_12 · 10.6084/m9.figshare.5104873.v1 · US09212190B2
查看![tert-butyl N-(4-[[(3R)-3-[2-[(tert-butyldimethylsilyl)oxy]ethyl]-7-thia-9,11-diazatricyclo[6.4.0.0[2,6]]dodeca-1(8),2(6),9,11-tetraen-12-yl]oxy]cyclohexyl)-N-ethylcarbamate 分子结构式](/api/mol/86695126/svg/360x280.svg)
HCID86695126
tert-butyl N-(4-[[(3R)-3-[2-[(tert-butyldimethylsilyl)oxy]ethyl]-7-thia-9,11-diazatricyclo[6.4.0.0[2,6]]dodeca-1(8),2(6),9,11-tetraen-12-yl]oxy]cyclohexyl)-N-ethylcarbamate
tert-butyl N-[4-[[(3R)-3-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl]oxy]cyclohexyl]-N-ethylcarbamate
C30H49N3O4SSi575.9 g/mol
IDENTITY
结构与身份
- 标准SMILES
- CCN(C(=O)OC(C)(C)C)C1CCC(Oc2ncnc3sc4c(c23)[C@@H](CCO[Si](C)(C)C(C)(C)C)CC4)CC1
- InChIKey
- ZAYFWWUSKOTSKH-ITAUSPCMSA-N
- 分子式
- C30H49N3O4SSi
- 平均分子量
- 575.9 g/mol
- 单同位素质量
- 575.32130476
COMPUTED
结构计算性质
- 极性表面积
- 102 Ų
- 氢键供体
- 0
- 氢键受体
- 7
- 可旋转键
- 11
- 重原子
- 39
- 形式电荷
- 0
- 复杂度
- 824
ALIASES
名称与别名
SCHEMBL15112119SCHEMBL15236496ZAYFWWUSKOTSKH-ITAUSPCMSA-Ntert-butyl N-(4-[[(3R)-3-[2-[(tert-butyldimethylsilyl)oxy]ethyl]-7-thia-9,11-diazatricyclo[6.4.0.0[2,6]]dodeca-1(8),2(6),9,11-tetraen-12-yl]oxy]cyclohexyl)-N-ethylcarbamate
REACTIONS
参与反应
uspto-grants-2015_12 · 10.6084/m9.figshare.5104873.v1 · US09212190B2
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