T95

N-(2,6-dimethylphenyl)-4-(2-ethoxyphenoxy)-2-({4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl}amino)pyrimidine-5-carboxamide


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Chemical Component Summary

NameN-(2,6-dimethylphenyl)-4-(2-ethoxyphenoxy)-2-({4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl}amino)pyrimidine-5-carboxamide
IdentifiersN-(2,6-dimethylphenyl)-4-(2-ethoxyphenoxy)-2-[[4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]amino]pyrimidine-5-carboxamide
FormulaC33 H38 N6 O4
Molecular Weight582.693
TypeNON-POLYMER
Isomeric SMILESCCOc1ccccc1Oc2c(cnc(n2)Nc3ccc(cc3)N4CCN(CC4)CCO)C(=O)Nc5c(cccc5C)C
InChIInChI=1S/C33H38N6O4/c1-4-42-28-10-5-6-11-29(28)43-32-27(31(41)36-30-23(2)8-7-9-24(30)3)22-34-33(37-32)35-25-12-14-26(15-13-25)39-18-16-38(17-19-39)20-21-40/h5-15,22,40H,4,16-21H2,1-3H3,(H,36,41)(H,34,35,37)
InChIKeyQFKVGNGFBPPYQL-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count81
Chiral Atom Count0
Bond Count85
Aromatic Bond Count24

Related Resource References

Resource NameReference
PubChem 25113175