![2-Propen-1-one, 1-[(3S)-4-[(7R)-7-[6-amino-4-methyl-3-(trifluoromethyl)-2-pyridinyl]-6-chloro-8-fluoro-2-[[(2S)-1-methyl-2-pyrrolidinyl]methoxy]-4-quinazolinyl]-3-methyl-1-piperazinyl]- structure, CAS 2417987-45-0](/structures/210000/194840_1_2417987_45_0.png)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 2417987-45-0 |
| Catalog No. | 2A-1193265 |
| Chinese Name | GDC-6036 |
| Molecular Formula | C29H32O2N7Cl1F4 |
| Molecular Weight | 622.07 |
| Application | GDC-6036 (compound 17a) is a potent K-Ras G12C inhibitor with IC50 less than 0.01μM. The EC50 of GDC-6036 in K-Ras G12C alkylated HCC1171 cells is 2 nM [1]. |
| PubChem ID | 406112088 |
| MDL Number | MFCD34603941 |
| SMILES | C=CC(=O)N1CCN(c2nc(OCC3CCCN3C)nc3c(F)c(-c4nc(N)cc(C)c4C(F)(F)F)c(Cl)cc23)C(C)C1 |
| 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 |
| InChI Key | ZRBPIAWWRPFDPY-IRXDYDNUSA-N |
| MSDS | msds/194840_1_2417987_45_0.pdf |
| Transport Info | Product Name: Divarasib |
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