HCID178425052

2-[(2-Chloro-6-methylphenyl)amino]-7,7-dimethyl-N-[5-(trifluoromethyl)pyridin-2-yl]-7,8-dihydro-1H-furo[3,2-e]benzimidazole-5-carboxamide

2-(2-chloro-6-methylanilino)-7,7-dimethyl-N-[5-(trifluoromethyl)-2-pyridinyl]-3,8-dihydrofuro[3,2-e]benzimidazole-5-carboxamide

C25H21ClF3N5O2515.9 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: Cc1cccc(Cl)c1Nc1nc2cc(C(=O)Nc3ccc(C(F)(F)F)cn3)c3c(c2[nH]1)CC(C)(C)O3
InChIKey: CMVCWCYAFXJCSR-UHFFFAOYSA-N
分子式: C25H21ClF3N5O2
平均分子量: 515.9 g/mol
单同位素质量: 515.1335871

COMPUTED

结构计算性质

已同步

XLogP: 6
极性表面积: 91.9 Å²
氢键供体: 3
氢键受体: 8
可旋转键: 4
重原子: 36
形式电荷: 0
复杂度: 817

ALIASES

名称与别名

共 5 条

CHEMBL4227894SCHEMBL2696887BDBM504605442-(2-chloro-6-methylanilino)-7,7-dimethyl-N-[5-(trifluoromethyl)pyridin-2-yl]-3,8-dihydrofuro[3,2-e]benzimidazole-5-carboxamide2-[(2-Chloro-6-methylphenyl)amino]-7,7-dimethyl-N-[5-(trifluoromethyl)pyridin-2-yl]-7,8-dihydro-1H-furo[3,2-e]benzimidazole-5-carboxamide

REACTIONS

参与反应

1 条

uspto-grants-2013_08 · 10.6084/m9.figshare.5104873.v1 · US08519149B2

查看