Showing RIpred-Card for Relugolix,2TMS,isomer#1 (RI01722103)

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 IDRI01722103
Compound Identification
Common NameRelugolix,2TMS,isomer#1
Structure
Average Molecular Weight767.2553
SMILESCOC1=CC=C(N2C(=O)C3=C(SC(C4=CC=C(N(C(=O)N(OC)[Si](C)(C)C)[Si](C)(C)C)C=C4)=C3CN(C)C)N(CC3=C(F)C=CC=C3F)C2=O)N=N1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4819.5645
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices