WK692
HIT218929654
sdf文件结构编辑类似物检索
HIT ID: HIT218929654
Cas No: 2694055-38-2
分子式: C26H28Br2N8O5
分子量: 692.369
常用名: WK692
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: [(2R)-1-[7-({3-[2-(2-bromoacetamido)ethoxy]-1-methyl-2-oxo-1,2-dihydroquinolin-6-yl}amino)-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]pyrrolidin-2-yl]methyl 2-bromoacetate
IUPAC: [(2R)-1-[7-({3-[2-(2-bromoacetamido)ethoxy]-1-methyl-2-oxo-1,2-dihydroquinolin-6-yl}amino)-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]pyrrolidin-2-yl]methyl 2-bromoacetate
SMILES: Cn1c2ccc(Nc3cc(nc4ncnn34)N3CCC[C@@H]3COC(=O)CBr)cc2cc(OCCNC(=O)CBr)c1=O
SMILES: Cn1c2ccc(Nc3cc(nc4ncnn34)N3CCC[C@@H]3COC(=O)CBr)cc2cc(OCCNC(=O)CBr)c1=O
InChI key: CLHCCXCOYINGCH-GOSISDBHSA-N
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