952475-78-4 Purity
96%
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The molecular formula of the compound is C16H15FN4O.
The synonyms of the compound are CHEMBL593854, 6-fluoro-2-(4-((methylamino)methyl)phenyl)-2H-indazole-7-carboxamide, 6-Fluoro-2-[4-[(methylamino)methyl]phenyl]-2H-indazole-7-carboxamide, SCHEMBL2264846, BDBM50306178.
The molecular weight of the compound is 298.31 g/mol.
The compound was created on July 9, 2010, and last modified on December 30, 2023.
The IUPAC name of the compound is 6-fluoro-2-[4-(methylaminomethyl)phenyl]indazole-7-carboxamide.
The InChI of the compound is InChI=1S/C16H15FN4O/c1-19-8-10-2-5-12(6-3-10)21-9-11-4-7-13(17)14(16(18)22)15(11)20-21/h2-7,9,19H,8H2,1H3,(H2,18,22).
The InChIKey of the compound is VAPIJKQVTBAYAU-UHFFFAOYSA-N.
The canonical SMILES of the compound is CNCC1=CC=C(C=C1)N2C=C3C=CC(=C(C3=N2)C(=O)N)F.
The XLogP3-AA value of the compound is 1.6.
The compound has 2 hydrogen bond donor counts and 4 hydrogen bond acceptor counts.