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恩替卡韦中间体N8 | 142217-81-0

恩替卡韦中间体N8
2-amino-9-[(1S,3R,4S)-4-(benzyloxy)-3-[(benzyloxy)methyl]-2-methylidenecyclopentyl]-9H-purin-6-ol
142217-81-0
C26H27N5O3
457.52428
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:恩替卡韦中间体N8结构式
135565404
名称和标识符
MDL MFCD11977291
InChIKey KROVOOOAPHSWCR-FKBYEOEOSA-N
Inchi 1S/C26H27N5O3/c1-17-20(15-33-13-18-8-4-2-5-9-18)22(34-14-19-10-6-3-7-11-19)12-21(17)31-16-28-23-24(31)29-26(27)30-25(23)32/h2-11,16,20-22H,1,12-15H2,(H3,27,29,30,32)/t20-,21-,22-/m0/s1
SMILES NC1=NC2=C(N=CN2[C@H]2C[C@H](OCC3=CC=CC=C3)[C@@H](COCC3=CC=CC=C3)C2=C)C(=O)N1
别名信息
- 中文别名 -
  • 恩替卡韦中间体N8
  • 恩替卡韦-8
  • 恩替卡韦中间体N-1
  • 2-氨基-1,9-二氢-9-[(1S,3R,4S)-4-苄氧基-3-苄氧基甲基-2-亚甲基环戊基]-6H-嘌呤-6-酮
  • 恩替卡韦中间体N8,2-氨基-1,9-二氢-9-[(1S,3R,4S)-4-苄氧基-3-苄氧基甲基-2-亚甲基环戊基]-6H-嘌呤-6-酮
  • 1-苄基-4-哌啶甲酸甲酯
  • 恩替卡韦 中间体-8
  • 恩替卡韦-9
  • 恩替卡韦中间体
  • 恩替卡韦中间体8
  • 恩替卡韦中间体E8
  • 2-氨基-9-((1S,3R,4S)-4-(苄氧基)-3-(苄氧基甲基)-2-亚甲基环戊基)-1H-嘌呤-6(9H)-酮
  • 3',5'-二-O-苄恩替卡韦
  • 3'.5'-二-O-苄基恩替卡韦
  • 恩替卡韦中间体9
- 英文别名 -
  • 2-Amino-9-((1S,3R,4S)-4-(benzyloxy)-3-((benzyloxy)methyl)-2-methylenecyclopentyl)-1H-purin-6(9H)-one
  • (1S,3R,4S)-2-amino-9-[4-(benzyloxy)-3-(benzyloxymethyl)-2-methylidene-cyclopentyl]-3H-purin-6-one
  • Entecavir intermediate N8
  • 2-Amino-1,9-dihydro-9-[(1S,3R,4S)-4-(benzyloxy)-3-(benzyloxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one
  • 2-Amino-9-((1S,3R,4S)-4-(benzyloxy)-3-((benzyloxy)-methyl)-2-methylenecyclopentyl)-1H-purin-6(9H)-one
  • 2-amino-9-((1S,3R,4S)-4-(benzyloxy)-3-(benzyloxymethyl)-2-methylenecyclopentyl)-1H-purin-6(9H)-one
  • 3’,5’-Di-O-benzyl Entecavir
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1S,3R,4S)-2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-
  • Entecavir Intermediate VIII
  • Entecavir N8
  • 2-AMINO-9-((1S,3R,4S)-4-(BENZYLOXY)-3-(BENZYLOXYMETHYL)-2-METHYLENECYCLOPHENTYL)-1H-PURIN-6(9H)-ONE
  • 3',5'-Di-O-benzyl Entecavir
  • Entecavir E8
  • Entecavir InterMediate N-1
  • Entecavir InterMediate VIII IsoMer
  • Entecavir-9
  • 6H-Purin-6-one,2-amino-1,9-dihydro-9-[2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-,[1S-(1a,3a,4b)]-
  • 2-amino-1,9-dihydro-9-[(1S,3R,4S)-2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-6H-Purin-6-one
  • 2-amino-9-[(1S,3R,4S)-4-(benzyloxy)-3-[(benzyloxy)methyl]-2-methylidenecyclopentyl]-9H-purin-6-ol
  • AKOS015896700
  • 2-Amino-1,9-dihydro-9-(4-(benzyloxy)-3-(benzyloxymethyl)-2-methylene cyclopentyl)-6H-purine-6-one, (1S,3R,4S)-
  • AM84385
  • CS-0158057
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-((1S,3R,4S)-2-methylene-4-(phenylmethoxy)-3-((phenylmethoxy)methyl)cyclopentyl)-
  • Q27280683
  • UNII-IEC6P1L62X
  • W-205570
  • 2-Amino-1,9-dihydro-9-[(1S,3R,4S)-2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-6H-purin-6-one
  • 2-amino-1,9-dihydro-9-((1s,3r,4s)-4-(benzyloxy)-3-(benzyloxymethyl)-2-methylenecyclopentyl)-6h-purin-6-one
  • 2-amino-9-((1s,3r,4s)-4-(benzyloxy)-3-(benzyloxymethyl)-2-methylenecyclopentyl)-1h-purin-6(9h)-one
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1S,3R,4S)-2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-
  • 3',5'-Di-O-Benzyl Entecavir
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[2-methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-, [1S-(1alpha,3alpha,4beta)]-
  • 2-amino-9-((1S,3R,4S)-4-(benzyloxy)-3-((benzyloxy)methyl)-2-methylenecyclopentyl)-1,9-dihydro-6H-purin-6-one
  • 142217-81-0
  • IEC6P1L62X
  • 2-Amino-1,9-dihydro-9-((1S,3R,4S)-4-(benzyloxy)-3-(benzyloxymethyl)-2-methylene cyclopentyl)-6H-purine-6-one
  • SCHEMBL8781248
  • AKOS025402354
  • AC-8329
  • 3',5'-Di-O-Benzylentecavir
  • C72661
  • C26H27N5O3
  • 2-amino-9-[(1S,3R,4S)-2-methylidene-4-phenylmethoxy-3-(phenylmethoxymethyl)cyclopentyl]-1H-purin-6-one
  • DS-18052
  • MFCD11977291
物化性质
实验特性
LogP 4.20240
PSA 108.05000
折射率 1.679
密度 1.34
计算特性
精确分子量 457.21100
氢键供体数量 3
氢键受体数量 8
可旋转化学键数量 8
同位素质量 457.21138974g/mol
重原子数量 34
复杂度 762
同位素原子数量 0
确定原子立构中心数量 3
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 2.2
拓扑分子极性表面积 104Ų
海关数据
海关编码 29335990
生产方法和用途
用途 恩替卡韦中间体。
专业数据库参考
PubChemId 135565404
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