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N-Boc-阿利克仑 | 173338-07-3

N-Boc-阿利克仑结构式图片|173338-07-3结构式图片
N-Boc-阿利克仑
N-Boc-Aliskiren
173338-07-3
C35H61N3O8
651.87414
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:N-Boc-阿利克仑结构式
N-Boc-阿利克仑价格
名称和标识符
InChIKey OKPJBCVKXMMXTJ-LJWNLINESA-N
Inchi InChI=1S/C35H61N3O8/c1-22(2)25(17-24-13-14-29(44-11)30(18-24)45-16-12-15-43-10)19-27(38-33(42)46-34(5,6)7)28(39)20-26(23(3)4)31(40)37-21-35(8,9)32(36)41/h13-14,18,22-23,25-28,39H,12,15-17,19-21H2,1-11H3,(H2,36,41)(H,37,40)(H,38,42)/t25-,26-,27-,28-/m0/s1
SMILES CC([C@H](C[C@H](NC(OC(C)(C)C)=O)[C@@H](O)C[C@H](C(NCC(C)(C(N)=O)C)=O)C(C)C)CC1=CC(OCCCOC)=C(OC)C=C1)C
别名信息
- 中文别名 -
  • [1S-[1R*(R*),2R*,4R*]]-[4-[[(3-氨基-2,2-二甲基-3-氧代丙基)氨基]羰基]-2-羟基-1-[2-[[4-甲氧基-3-(3-甲氧基丙氧基)苯基]甲基]-3-甲基丁基]-5-甲基己基]-氨基甲酸叔丁酯
  • N-[(1S,2S,4S)-4-[[(3-氨基-2,2-二甲基-3-氧代丙基)氨基]羰基]-2-羟基-1-[(2S)-2-[[4-甲氧基-3-(3-甲氧基丙氧基)苯基]甲基]-3-甲基丁基]-5-甲基己基]氨基甲酸叔丁酯
- 英文别名 -
  • tert-Butyl ((3S,5S,6S,8S)-8-((3-amino-2,2-dimethyl-3-oxopropyl)carbamoyl)-6-hydroxy-3-(4-methoxy-3-(3-methoxypropoxy)benzyl)-2,9-dimethyldecan-5-yl)carbamate
  • N-Boc-Aliskiren
  • tert-Butyl ((3S,5S,6S,8S)-8-((3-amino-2,2-dimethyl-3-oxopropyl)carbamoyl)-6-hydr xy-3-(4-methoxy-3-(3-methoxypropoxy)benzyl)-2,9-dimethyldecan-5-yl)carbamate
  • tert-Butyl ((3S,5S,6S,8S)-8-((3-amino-2,2-dimethyl-3-oxopropyl)carbamoyl)-6-hydroxy-3-(4-methoxy-3-(3-methoxypropoxy)benzyl)-
  • TERT-BUTYL (3S,5S,6S,8S)-8-(3-AMINO-2,2-DIMETHYL-3-OXOPROPYLCARBAMOYL)-6-HYDROXY-3-(4-METHOXY-3-(3-METHOXYPROPOXY)BENZY...
  • (1S,2S,4S)-4-(2-carbamoyl-2-methylpropylcarbamoyl)-2-hydroxy-1-{(S)-2-[4-methoxy-3-(3-methoxypropoxy)-benzyl]-3-methylbutyl}-5-methylhexyl carbamic acid tert-butyl ester
  • CTK4D4601
  • KB-63744
  • tert-butyl (3S,5S,6S,8S)-8-(3-amino-2,2-dimethyl-3-oxopropylcarbamoyl)-6-hydroxy-3-(4-methoxy-3-(3-methoxypropoxy)benzyl)-2,9-dimethyldecan-5-ylcarbamate
  • tert-butyl N-[(1S,2S,4S)-4-[(3-aMino-2,2-diMethyl-3-oxo-propyl)carbaMoyl]-2-hydroxy-1-[(2S)-2-[[4-Methoxy-3-(3-Methoxypropoxy)phenyl]Methyl]-3-Methyl-butyl]-5-Methyl-hexyl]carbaMate
  • N-[(1S,2S,4S)-4-[[(3-Amino-2,2-dimethyl-3-oxopropyl)amino]carbonyl]-2-hydroxy-1-[(2S)-2-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-3-methylbutyl]-5-methylhexyl]carbamic acid 1,1-dimethylethyl ester
  • CarbaMic acid, [4-[[(3-aMino-2,2-diMethyl-3-oxopropyl)aMino]carbonyl]-2-hydroxy-1-[2-[[4-Methoxy-3-(3-Methoxypropoxy)phenyl]Methyl]-3-Methylbutyl]-5-Methylhexyl]-, 1,1-diMethylethyl ester, [1S-[1R*(R*),2R*,4R*]]-
  • N-Boc-Aliskiren
物化性质
实验特性
LogP 6.34160
PSA 158.44000
熔点 141-142 ºC (ethyl ether hexane )
溶解度 Insuluble (5.9E-3 g/L) (25 ºC),
密度 1.071±0.06 g/cm3 (20 ºC 760 Torr),
计算特性
精确分子量 651.44600
氢键供体数量 4
氢键受体数量 11
可旋转化学键数量 24
重原子数量 46
960化工网为您提供N-Boc-阿利克仑专业化合物百科信息,包括中文名,英文名,分子式,分子量,以及该化合物的CasNo.:173338-07-3,和相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等;| WAP 版:173338-07-3
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