CHEBI:91406 - 5-chloro-N2-[1-(5-fluoro-2-pyrimidinyl)ethyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

ChEBI IDCHEBI:91406
ChEBI Name5-chloro-N2-[1-(5-fluoro-2-pyrimidinyl)ethyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
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FormulaC14H14ClFN8
Net Charge0
Average Mass348.773
Monoisotopic Mass348.10140
SMILESCc1cc(Nc2nc(NC(C)c3ncc(F)cn3)ncc2Cl)nn1
InChIInChI=1S/C14H14ClFN8/c1-7-3-11(24-23-7)21-13-10(15)6-19-14(22-13)20-8(2)12-17-4-9(16)5-18-12/h3-6,8H,1-2H3,(H3,19,20,21,22,23,24)
InChIKeyPDOQBOJDRPLBQU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-chloro-N2-[1-(5-fluoro-2-pyrimidinyl)ethyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine (CHEBI:91406) is a organohalogen compound (CHEBI:17792)
5-chloro-N2-[1-(5-fluoro-2-pyrimidinyl)ethyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine (CHEBI:91406) is a pyrimidines (CHEBI:39447)
Manual XrefsDatabases
LSM-1140LINCS