Tec-IN-14
HIT101504053
sdf文件结构编辑类似物检索
HIT ID: HIT101504053
Cas No: 852838-07-4
分子式: C18H16BrN3O4
分子量: 418.247
常用名: Tec-IN-14
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 2.673
IUPAC: {7-bromo-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
IUPAC: {7-bromo-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
SMILES: CC(=O)c1c(C)[nH]c(C(=O)OCc2cc(=O)n3cc(Br)ccc3n2)c1C
SMILES: CC(=O)c1c(C)[nH]c(C(=O)OCc2cc(=O)n3cc(Br)ccc3n2)c1C
InChI key: FSNZIHKIOIUBHQ-UHFFFAOYSA-N
共显示2个结果
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TargetMol
SC
106006-8周 购物车
Enamine
SC
9763-5周 购物车
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