RI01722351 | Zanubrutinib,3TBDMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C(C)(C)C)C3=C(C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 813.4865 | Semi standard non polar | 4882.535 |
RI01722350 | Zanubrutinib,2TBDMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 699.4 | Semi standard non polar | 4858.147 |
RI01722349 | Zanubrutinib,2TBDMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C(C)(C)C)C3=C(C(=O)N[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 699.4 | Semi standard non polar | 4803.2173 |
RI01722348 | Zanubrutinib,1TBDMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C(C)(C)C)C3=C(C(N)=O)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 585.3135 | Semi standard non polar | 4718.9653 |
RI01722347 | Zanubrutinib,1TBDMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 585.3135 | Semi standard non polar | 4801.085 |
RI01722346 | Zanubrutinib,3TMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C)C3=C(C(=O)N([Si](C)(C)C)[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 687.3456 | Semi standard non polar | 4436.1504 |
RI01722345 | Zanubrutinib,2TMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N([Si](C)(C)C)[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 615.3061 | Semi standard non polar | 4539.0684 |
RI01722344 | Zanubrutinib,2TMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C)C3=C(C(=O)N[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 615.3061 | Semi standard non polar | 4471.175 |
RI01722343 | Zanubrutinib,1TMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C)C3=C(C(N)=O)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 543.2666 | Semi standard non polar | 4521.629 |
RI01722342 | Zanubrutinib,1TMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 543.2666 | Semi standard non polar | 4595.286 |
RI01722341 | Zanubrutinib,3TBDMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C(C)(C)C)C3=C(C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 813.4865 | Standard non polar | 4077.4785 |
RI01722340 | Zanubrutinib,2TBDMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 699.4 | Standard non polar | 3876.0034 |
RI01722339 | Zanubrutinib,2TBDMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C(C)(C)C)C3=C(C(=O)N[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 699.4 | Standard non polar | 3768.5728 |
RI01722338 | Zanubrutinib,1TBDMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C(C)(C)C)C3=C(C(N)=O)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 585.3135 | Standard non polar | 3459.0833 |
RI01722337 | Zanubrutinib,1TBDMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N[Si](C)(C)C(C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TBDMS | 585.3135 | Standard non polar | 3625.6646 |
RI01722336 | Zanubrutinib,3TMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C)C3=C(C(=O)N([Si](C)(C)C)[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 687.3456 | Standard non polar | 3387.664 |
RI01722335 | Zanubrutinib,2TMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N([Si](C)(C)C)[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 615.3061 | Standard non polar | 3547.9805 |
RI01722334 | Zanubrutinib,2TMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C)C3=C(C(=O)N[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 615.3061 | Standard non polar | 3264.1963 |
RI01722333 | Zanubrutinib,1TMS,isomer#2 | JsmolC=CC(=O)N1CCC([C@@H]2CCN([Si](C)(C)C)C3=C(C(N)=O)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 543.2666 | Standard non polar | 3161.7368 |
RI01722332 | Zanubrutinib,1TMS,isomer#1 | JsmolC=CC(=O)N1CCC([C@@H]2CCNC3=C(C(=O)N[Si](C)(C)C)C(C4=CC=C(OC5=CC=CC=C5)C=C4)=NN32)CC1 | TMS | 543.2666 | Standard non polar | 3462.2107 |
RI01722331 | Cedazuridine,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](N2CC[C@@H](O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C2=O)C(F)(F)[C@@H]1O[Si](C)(C)C(C)(C)C | TBDMS | 724.433 | Standard polar | 2655.7903 |
RI01722330 | Cedazuridine,4TMS,isomer#1 | JsmolC[Si](C)(C)OC[C@H]1O[C@@H](N2CC[C@@H](O[Si](C)(C)C)N([Si](C)(C)C)C2=O)C(F)(F)[C@@H]1O[Si](C)(C)C | TMS | 556.2452 | Standard polar | 2278.2554 |
RI01722329 | Cedazuridine,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](N2CC[C@@H](O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C2=O)C(F)(F)[C@@H]1O[Si](C)(C)C(C)(C)C | TBDMS | 724.433 | Semi standard non polar | 2917.9556 |
RI01722328 | Cedazuridine,4TMS,isomer#1 | JsmolC[Si](C)(C)OC[C@H]1O[C@@H](N2CC[C@@H](O[Si](C)(C)C)N([Si](C)(C)C)C2=O)C(F)(F)[C@@H]1O[Si](C)(C)C | TMS | 556.2452 | Semi standard non polar | 2075.982 |
RI01722327 | Cedazuridine,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](N2CC[C@@H](O[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C2=O)C(F)(F)[C@@H]1O[Si](C)(C)C(C)(C)C | TBDMS | 724.433 | Standard non polar | 3061.3135 |