Showing RIpred-Card for Zanubrutinib,1TMS,isomer#2 (RI01722353)

Jump To Section:
IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722353
Compound Identification
Common NameZanubrutinib,1TMS,isomer#2
Structure
Average Molecular Weight543.2666
SMILESC=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
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5641.0464
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices