Divarasib (GDC-6036, RG6330) is a KRAS G12C inhibitor that irreversibly binds to the switch II pocket of KRAS G12C (when in an inactive GDP-binding state), thereby blocking GTP binding and activation.

 

Brand: BCM

 

Boiling Point: 743.4±70.0 °C(Predicted)

 

pKa: 9.13±0.40(Predicted)

 

Solubility: Soluble in DMSO; Soluble in Ethanol. Insoluble in Water.

 

Isomeric SMILES: C[C@H]1CN(CCN1C2=NC(=NC3=C(C(=C(C=C32)Cl)C4=C(C(=CC(=N4)N)C)C(F)(F)F)F)OC[C@@H]5CCCN5C)C(=O)C=C  

 

InChIKey: ZRBPIAWWRPFDPY-IRXDYDNUSA-N  

 

InChI: InChI=1S/C29H32ClF4N7O2/c1-5-21(42)40-9-10-41(16(3)13-40)27-18-12-19(30)22(26-23(29(32,33)34)15(2)11-20(35)36-26)24(31)25(18)37-28(38-27)43-14-17-7-6-8-39(17)4/h5,11-12,16-17H,1,6-10,13-14H2,2-4H3,(H2,35,36)/t16-,17-/m0/s1 

 

Attribute
[Chem Name]	1-[(3S)-4-[7-[6-amino-4-methyl-3-(trifluoromethyl)pyridin-2-yl]-6-chloro-8-fluoro-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]quinazolin-4-yl]-3-methylpiperazin-1-yl]prop-2-en-1-one
[Synonym]	Divarasib; GDC-6036; RG6330
[CAS No.]	2417987-45-0
[Formula]	C29H32ClF4N7O2
[Molecular]	622.06
[Form]	Solid Powder
[Storage]	Sealed in dry. Stored at -20°C.

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