uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08536338B2
查看![6-(N-ethylmethylsulfonamido)-2-(4-fluorophenyl)-N-methyl-5-(3-(1-(pyridin-2-yl)cyclopropylcarbamoyl)phenyl)pyrazolo[1,5-a]pyridine-3-carboxamide 分子结构式](/api/mol/46842508/svg/360x280.svg)
HCID46842508
6-(N-ethylmethylsulfonamido)-2-(4-fluorophenyl)-N-methyl-5-(3-(1-(pyridin-2-yl)cyclopropylcarbamoyl)phenyl)pyrazolo[1,5-a]pyridine-3-carboxamide
6-[ethyl(methylsulfonyl)amino]-2-(4-fluorophenyl)-N-methyl-5-[3-[(1-pyridin-2-ylcyclopropyl)carbamoyl]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
C33H31FN6O4S626.7 g/mol
IDENTITY
结构与身份
- 标准SMILES
- CCN(c1cn2nc(-c3ccc(F)cc3)c(C(=O)NC)c2cc1-c1cccc(C(=O)NC2(c3ccccn3)CC2)c1)S(C)(=O)=O
- InChIKey
- QDVYJFBPZGOAIP-UHFFFAOYSA-N
- 分子式
- C33H31FN6O4S
- 平均分子量
- 626.7 g/mol
- 单同位素质量
- 626.21115283
COMPUTED
结构计算性质
- XLogP
- 3.3
- 极性表面积
- 134 Ų
- 氢键供体
- 2
- 氢键受体
- 8
- 可旋转键
- 9
- 重原子
- 45
- 形式电荷
- 0
- 复杂度
- 1,170
ALIASES
名称与别名
SCHEMBL2464251QDVYJFBPZGOAIP-UHFFFAOYSA-N6-(N-ethylmethylsulfonamido)-2-(4-fluorophenyl)-N-methyl-5-(3-(1-(pyridin-2-yl)cyclopropylcarbamoyl)phenyl)pyrazolo[1,5-a]pyridine-3-carboxamide
REACTIONS
