Pro_Molecular_Structure:
pro_cdbregno:CCD02500346
N-[4-[1-(1,4-二氧杂螺[4.5]癸烷-8-基)-4-(8-氧杂-3-氮杂双环[3.2.1]辛烷-3-基)-1H-吡唑并[3,4-d]嘧啶-6-基]苯基]-N'-甲基脲
pro_cas:
1144068-46-1
pro_formula:C27 H33 N7 O4
pro_molWeight:519.603
![N-[4-[1-(1,4-二氧杂螺[4.5]癸烷-8-基)-4-(8-氧杂-3-氮杂双环[3.2.1]辛烷-3-基)-1H-吡唑并[3,4-d]嘧啶-6-基]苯基]-N'-甲基脲 Detailed](../images/deli.png)
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| Product_Name： | N-[4-[1-(1,4-二氧杂螺[4.5]癸烷-8-基)-4-(8-氧杂-3-氮杂双环[3.2.1]辛烷-3-基)-1H-吡唑并[3,4-d]嘧啶-6-基]苯基]-N'-甲基脲 |
| CAS： | 1144068-46-1 |
| 中文同义词： | N-[4-[1-(1,4-二氧杂螺[4.5]癸烷-8-基)-4-(8-氧杂-3-氮杂双环[3.2.1]辛烷-3-基)-1H-吡唑并[3,4-d]嘧啶-6-基]苯基]-N'-甲基脲 |
| EnglishSynonyms： | WYE-125132 (WYE-132) ; UREA, N-[4-[1-(1,4-DIOXASPIRO[4.5]DEC-8-YL)-4-(8-OXA-3-AZABICYCLO[3.2.1]OCT-3-YL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]PHENYL]-N'-METHYL- ; 1-(4-(4-(8-OXA-3-AZABICYCLO[3.2.1]OCTAN-3-YL)-1-(1,4-DIOXASPIRO[4.5]DECAN-8-YL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL)PHENYL)-3-METHYLUREA ; WYE-125132 ; N-[4-[1-(1,4-DIOXASPIRO[4.5]DEC-8-YL)-4-(8-OXA-3-AZABICYCLO[3.2.1]OCT-3-YL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]PHENYL]-N'-METHYLUREA ; WYE132 |
| pro_mdlNumber： | MFCD16038851 |
| pro_acceptors： | 11 |
| pro_donors： | 2 |
| pro_smile： | CNC(=O)Nc1ccc(cc1)c2nc3c(cnn3C4CCC5(CC4)OCCO5)c(n2)N6C[C@@H]7CC[C@H](C6)O7 |
| InChi： | InChI=1S/C27H33N7O4/c1-28-26(35)30-18-4-2-17(3-5-18)23-31-24(33-15-20-6-7-21(16-33)38-20)22-14-29-34(25(22)32-23)19-8-10-27(11-9-19)36-12-13-37-27/h2-5,14,19-21H,6-13,15-16H2,1H3,(H2,28,30,35)/t20-,21+ |
| InChiKey： | InChIKey=QLHHRYZMBGPBJG-OYRHEFFESA-N |
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basic_info
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