HCID59336217

methyl 4-fluoro-1-methyl-5-(phenylamino)-1H-benzo[d]imidazole-6-carboxylate

methyl 6-anilino-7-fluoro-3-methylbenzimidazole-5-carboxylate

C16H14FN3O2299.3 g/molCAS 1415564-48-5

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IDENTITY

结构与身份

标准 SMILES: COC(=O)c1cc2c(ncn2C)c(F)c1Nc1ccccc1
InChIKey: QKGGOULHLAXMCL-UHFFFAOYSA-N
分子式: C16H14FN3O2
平均分子量: 299.3 g/mol
单同位素质量: 299.10700486

COMPUTED

结构计算性质

已同步

XLogP: 3.5
极性表面积: 56.2 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 4
重原子: 22
形式电荷: 0
复杂度: 403

ALIASES

名称与别名

共 15 条

methyl 4-fluoro-1-methyl-5-(phenylamino)-1H-benzo[d]imidazole-6-carboxylate1415564-48-5methyl 6-anilino-7-fluoro-3-methylbenzimidazole-5-carboxylateSCHEMBL6727101CHEMBL4945569DTXSID501128995CS-M0965MFCD18782779XH0201AKOS027473730CS-13747F788945methyl 6-anilino-7-fluoro-3-methyl-benzimidazole-5-carboxylateMethyl 5-anilino-4-fluoro-1-methyl-1H-benzimidazole-6-carboxylate1H-Benzimidazole-6-carboxylic acid, 4-fluoro-1-methyl-5-(phenylamino)-, methyl ester

REACTIONS