基本情報
- CAS
312904-60-2- 標準SMILES
Cc1cnc(NCC(F)(F)c2ccccn2)c(=O)n1CC(=O)NCc1ncccc1F- InChIKey
JXHWVKOKYDAROD-UHFFFAOYSA-N- 分子式
- C20H19F3N6O2
- 平均分子量
- 432.4 g/mol
- 単同位体質量
- 432.15215836
名称と識別子
- 優先名称
- 2-(6-Chloro-3-((2,2-difluoro-2-(2-pyridinyl)ethyl)amino)-2-oxo-1(2H)-pyrazinyl)-N-((2-fluoro-6-pyridinyl)methyl)acetamide
- IUPAC
- 2-[3-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-6-methyl-2-oxopyrazin-1-yl]-N-[(3-fluoro-2-pyridinyl)methyl]acetamide
名称と別名
2-(6-CHLORO-3-{[2,2-DIFLUORO-2-(2-PYRIDINYL)ETHYL]AMINO}-2-OXO-1(2H)-PYRAZINYL)-N-[(2-FLUORO-6-PYRIDINYL)METHYL]ACETAMIDE2-(3-((2,2-difluoro-2-(pyridin-2-yl)ethyl)amino)-6-methyl-2-oxo-1,2-dihydropyrazin-1-yl)-N-((3-fluoropyridin-2-yl)methyl)acetamide2-(3-{[2,2-difluoro-2-(pyridin-2-yl)ethyl]amino}-6-methyl-2-oxo-1,2-dihydropyrazin-1-yl)-N-[(3-fluoropyridin-2-yl)methyl]acetamide2-(6-Chloro-3-((2,2-difluoro-2-(2-pyridinyl)ethyl)amino)-2-oxo-1(2H)-pyrazinyl)-N-((2-fluoro-6-pyridinyl)methyl)acetamideRefChem:459170CHEMBL141889312904-60-22-(3-((2,2-Difluoro-2-(pyridin-2-yl)ethyl)amino)-6-methyl-2-oxopyrazin-1(2H)-yl)-N-((3-fluoropyridin-2-yl)methyl)acetamide1mu6JXHWVKOKYDAROD-UHFFFAOYSA-NJXHWVKOKYDAROD-UHFFFAOYSA-ODTXSID601106188
名称をさらに表示
BDBM50123491DB07548PD005083Q270967692-[3-(2,2-Difluoro-2-pyridin-2-yl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-N-(3-fluoro-pyridin-2-ylmethyl)-acetamide2-{3-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-6-methyl-2-oxopyrazin-1(2H)-yl}-N-[(3-fluoropyridin-2-yl)methyl]acetamide3-[[2,2-Difluoro-2-(2-pyridinyl)ethyl]amino]-N-[(3-fluoro-2-pyridinyl)methyl]-6-methyl-2-oxo-1(2H)-pyrazineacetamide
物性
構造計算による物性
- XLogP
- 0.7
- 極性表面積
- 99.6 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 8
- 回転可能結合数
- 8
- 重原子数
- 31
- 形式電荷
- 0
- 複雑度
- 730
関連反応
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