5-{[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino}-2-methyl-9-(2,2,2-trifluoroethyl)-2,4,6,9-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one

Compound number
MolPort-047-154-554
CAS number
2222635-15-4
IUPAC
5-{[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino}-2-methyl-9-(2,2,2-trifluoroethyl)-2,4,6,9-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one
IUPAC traditional
5-{[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino}-2-methyl-9-(2,2,2-trifluoroethyl)-2,4,6,9-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one
SMILES
COc1cc(ccc1Nc1ncc2N(CC(F)(F)F)C(=O)c3ccccc3N(C)c2n1)N1CCN(C)CC1
InChI key
OQFCHSFVWSLDAO-UHFFFAOYSA-N
Molecular formula
Molecular weight
527.552
Solubility
not available

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AA BLOCKS

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Angene International Limited

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More Information

Compound identifiers

Compound number
MolPort-047-154-554
CAS number
2222635-15-4

Names, Synonyms and 3rd Party Identifiers

2-(2-Methoxy-4-(4-methylpiperazin-1-yl)phenylamino)-11-methyl-5-(2,2,2-trifluoroethyl)-5H-benzo[e]pyrimido[5,4-b][1,4]diazepin-6(11H)-one
5,11-Dihydro-2-[[2-methoxy-4-(4-methyl-1-piperazinyl)phenyl]amino]-11-methyl-5-(2,2,2-trifluoroethyl)-6H-pyrimido[4,5-b][1,4]benzodiazepin-6-one
DCLK1-IN-1
FMF-03-146-1

InChI

InChI
1/C26H28F3N7O2/c1-33-10-12-35(13-11-33)17-8-9-19(22(14-17)38-3)31-25-30-15-21-23(32-25)34(2)20-7-5-4-6-18(20)24(37)36(21)16-26(27,28)29/h4-9,14-15H,10-13,16H2,1-3H3,(H,30,31,32)
InChI key
OQFCHSFVWSLDAO-UHFFFAOYSA-N

Formula

Molecular formula
C26H28F3N7O2
Molecular weight
527.552

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