Name: PROTAC IRAK4 degrader-8
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218851190
Cas No:2911615-06-8
常用名:PROTAC IRAK4 degrader-8
IUPAC:N-[3-(difluoromethyl)-1-[(1r,4r)-4-({9-[4-chloro-3-(2,4-dioxo-1,3-diazinan-1-yl)benzoyl]-3,9-diazaspiro[5.5]undecan-3-yl}methyl)cyclohexyl]-1H-pyrazol-4-yl]-5-[(1R,4R)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
IUPAC:N-[3-(difluoromethyl)-1-[(1r,4r)-4-({9-[4-chloro-3-(2,4-dioxo-1,3-diazinan-1-yl)benzoyl]-3,9-diazaspiro[5.5]undecan-3-yl}methyl)cyclohexyl]-1H-pyrazol-4-yl]-5-[(1R,4R)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
InChI key:RGQCBKDSLKTVFN-PYYPWFDZSA-N

分子式:C43H50ClF2N11O5
分子量:874.39
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12CN(c3ccn4ncc(C(=O)Nc5cn(nc5C(F)F)[C@H]5CC[C@H](CN6CCC7(CC6)CCN(CC7)C(=O)c6ccc(Cl)c(c6)N6CCC(=O)NC6=O)CC5)c4n3)[C@@]([H])(CO1)C2
SMILES:[H][C@@]12CN(c3ccn4ncc(C(=O)Nc5cn(nc5C(F)F)[C@H]5CC[C@H](CN6CCC7(CC6)CCN(CC7)C(=O)c6ccc(Cl)c(c6)N6CCC(=O)NC6=O)CC5)c4n3)[C@@]([H])(CO1)C2

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