6CY

5-{4-[3-(4-acetylpiperazine-1-carbonyl)phenyl]quinazolin-6-yl}-2-methoxypyridine-3-carbonitrile


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Chemical Component Summary

Name5-{4-[3-(4-acetylpiperazine-1-carbonyl)phenyl]quinazolin-6-yl}-2-methoxypyridine-3-carbonitrile
Identifiers5-[4-[3-(4-ethanoylpiperazin-1-yl)carbonylphenyl]quinazolin-6-yl]-2-methoxy-pyridine-3-carbonitrile
FormulaC28 H24 N6 O3
Molecular Weight492.529
TypeNON-POLYMER
Isomeric SMILESCC(=O)N1CCN(CC1)C(=O)c2cccc(c2)c3c4cc(ccc4ncn3)c5cc(c(nc5)OC)C#N
InChIInChI=1S/C28H24N6O3/c1-18(35)33-8-10-34(11-9-33)28(36)21-5-3-4-20(12-21)26-24-14-19(6-7-25(24)31-17-32-26)23-13-22(15-29)27(37-2)30-16-23/h3-7,12-14,16-17H,8-11H2,1-2H3
InChIKeyQYTXJLQBSYAMGR-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count61
Chiral Atom Count0
Bond Count65
Aromatic Bond Count23

Related Resource References

Resource NameReference
Pharos CHEMBL3977066
PubChem 86732669
ChEMBL CHEMBL3977066